smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC[C@H]([NH2+][C@@H]1C[C@H]([NH3+])C12CCC2)c1cccc([N+](=O)[O-])c1 ZINC000925540486 618899123 /nfs/dbraw/zinc/89/91/23/618899123.db2.gz CKEMFCYNTDTHFP-SOUVJXGZSA-N 2 0 289.379 2.905 20 5 CFBDRP C[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C1CCC([NH3+])CC1 ZINC000093633734 619041730 /nfs/dbraw/zinc/04/17/30/619041730.db2.gz SGWMQVGDCIGHJE-UHFFFAOYSA-N 2 0 297.786 2.950 20 5 CFBDRP CCC[C@@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000902486772 621111936 /nfs/dbraw/zinc/11/19/36/621111936.db2.gz BPCCFPQMMCULLX-UXIGCNINSA-N 2 0 277.368 2.763 20 5 CFBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC(C)(C)[NH3+] ZINC000903939271 621474318 /nfs/dbraw/zinc/47/43/18/621474318.db2.gz FCSQBGAKHUYPNL-LBPRGKRZSA-N 2 0 279.384 2.633 20 5 CFBDRP C[C@@H]([NH2+]C[C@@H]1CC[NH2+][C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000903987444 621499472 /nfs/dbraw/zinc/49/94/72/621499472.db2.gz GJCJZAANJZVCRM-JHJVBQTASA-N 2 0 277.368 2.634 20 5 CFBDRP C[C@H]([NH2+]C[C@H]1CC[NH2+][C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000903987442 621499654 /nfs/dbraw/zinc/49/96/54/621499654.db2.gz GJCJZAANJZVCRM-AVGNSLFASA-N 2 0 277.368 2.634 20 5 CFBDRP C[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC[C@@H]1C[NH3+] ZINC000904411995 621593371 /nfs/dbraw/zinc/59/33/71/621593371.db2.gz YUXCITHDBUVPSA-CMPLNLGQSA-N 2 0 297.786 2.665 20 5 CFBDRP Cc1c(CNCCC[N@@H+](C)C(C)C)cccc1[N+](=O)[O-] ZINC000226390116 623072075 /nfs/dbraw/zinc/07/20/75/623072075.db2.gz HWEBCCUTIBYBJS-UHFFFAOYSA-N 2 0 279.384 2.723 20 5 CFBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C[NH3+])[C@H](C)C1 ZINC000923497916 626477179 /nfs/dbraw/zinc/47/71/79/626477179.db2.gz NEURJZRHJWDHIF-UPJWGTAASA-N 2 0 277.368 2.573 20 5 CFBDRP C[C@H]1C[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC[C@H]1C[NH3+] ZINC000923499203 626477480 /nfs/dbraw/zinc/47/74/80/626477480.db2.gz RHHBADVGRISYGJ-QWRGUYRKSA-N 2 0 297.786 2.665 20 5 CFBDRP C[C@H](CC[NH+](C)C)[NH2+][C@@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866249595 638779846 /nfs/dbraw/zinc/77/98/46/638779846.db2.gz LWSAMKWRPSLWPN-NEPJUHHUSA-N 2 0 297.374 2.595 20 5 CFBDRP C[C@@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1ccccc1[N+](=O)[O-] ZINC000873297328 642127998 /nfs/dbraw/zinc/12/79/98/642127998.db2.gz WJVCEARTPRKKGH-GRYCIOLGSA-N 2 0 263.341 2.515 20 5 CFBDRP CC1(C)[NH2+]CC[C@H]1[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000925571812 648223072 /nfs/dbraw/zinc/22/30/72/648223072.db2.gz JGMZIQKIOHDBBP-OAHLLOKOSA-N 2 0 291.395 2.648 20 5 CFBDRP C[C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1OCC[N+](C)(C)C ZINC001224772037 775270201 /nfs/dbraw/zinc/27/02/01/775270201.db2.gz WIAAUBQJHYNSRQ-SJLPKXTDSA-N 2 0 291.459 2.620 20 5 CFBDRP C[N+](C)(C)CCO[C@@H]1CC[N@H+](Cc2ccccc2Cl)C1 ZINC001224776493 775271569 /nfs/dbraw/zinc/27/15/69/775271569.db2.gz WKNUUUFMJIYPAS-OAHLLOKOSA-N 2 0 297.850 2.637 20 5 CFBDRP C[C@H](c1cccc(O[C@@H](C)C[N+](C)(C)C)c1)[NH+](C)C ZINC001229620790 776859091 /nfs/dbraw/zinc/85/90/91/776859091.db2.gz DLNJSVPWQSCCLP-UONOGXRCSA-N 2 0 265.421 2.783 20 5 CFBDRP C[N@H+](CCCCCC[NH3+])Cc1cccc([N+](=O)[O-])c1 ZINC000710819397 781340800 /nfs/dbraw/zinc/34/08/00/781340800.db2.gz QBKKAEWHNWCJNM-UHFFFAOYSA-N 2 0 265.357 2.546 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000594512003 349436548 /nfs/dbraw/zinc/43/65/48/349436548.db2.gz SRSWPXAPWKQDQQ-KCQAQPDRSA-N 2 0 291.395 2.894 20 5 CFBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1([NH3+])CCCC1 ZINC000594739282 349485609 /nfs/dbraw/zinc/48/56/09/349485609.db2.gz SGLUILBZURKKDB-ZDUSSCGKSA-N 2 0 291.395 2.777 20 5 CFBDRP C[C@@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H]1CC[NH3+] ZINC000404411543 348591280 /nfs/dbraw/zinc/59/12/80/348591280.db2.gz XWRFMUQMCUNIAL-CZUORRHYSA-N 2 0 291.395 2.587 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@H]2CC23CC[NH2+]CC3)cc1[N+](=O)[O-] ZINC000591579303 349031559 /nfs/dbraw/zinc/03/15/59/349031559.db2.gz HXDNNVMPJJVUOF-WFASDCNBSA-N 2 0 289.379 2.696 20 5 CFBDRP C[C@H]1C[C@H](C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)CC[NH2+]1 ZINC000414712749 233335448 /nfs/dbraw/zinc/33/54/48/233335448.db2.gz OGVQHBQIHYPKSV-QWHCGFSZSA-N 2 0 291.395 2.808 20 5 CFBDRP C[N@@H+]1CC[C@@H]([NH2+]CCc2ccccc2[N+](=O)[O-])CC1(C)C ZINC000598962105 350349779 /nfs/dbraw/zinc/34/97/79/350349779.db2.gz RXIDHZPZHALECU-CQSZACIVSA-N 2 0 291.395 2.600 20 5 CFBDRP C[C@H]([NH3+])C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000110651293 186311558 /nfs/dbraw/zinc/31/15/58/186311558.db2.gz PMKKFJVGJOAIAG-JTQLQIEISA-N 2 0 297.786 2.807 20 5 CFBDRP C[N@@H+]1CCC[C@H]2CN(Cc3csc([N+](=O)[O-])c3)CC[C@@H]21 ZINC000158644845 188387463 /nfs/dbraw/zinc/38/74/63/188387463.db2.gz GXMUOCHMOKOEFY-STQMWFEESA-N 2 0 295.408 2.572 20 5 CFBDRP CC[N@H+](Cc1ccc([N+](=O)[O-])cc1C)[C@H]1CCC[NH2+]CC1 ZINC000435394665 240311856 /nfs/dbraw/zinc/31/18/56/240311856.db2.gz ONFCHPQFHMKNDP-HNNXBMFYSA-N 2 0 291.395 2.867 20 5 CFBDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000037644208 372682195 /nfs/dbraw/zinc/68/21/95/372682195.db2.gz KKBHGOHJJUPVDV-STQMWFEESA-N 2 0 277.368 2.587 20 5 CFBDRP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000037649076 372683680 /nfs/dbraw/zinc/68/36/80/372683680.db2.gz RLMAZQJYXUPRKH-CHWSQXEVSA-N 2 0 289.379 2.730 20 5 CFBDRP CCC[C@H]([NH2+]CCCC[NH3+])c1cccc([N+](=O)[O-])c1 ZINC000037715227 372692843 /nfs/dbraw/zinc/69/28/43/372692843.db2.gz XNOYLJDXDAWASC-AWEZNQCLSA-N 2 0 265.357 2.765 20 5 CFBDRP C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(CC[NH3+])CC1 ZINC000070187471 374143213 /nfs/dbraw/zinc/14/32/13/374143213.db2.gz CWZXCFKGFGQSFD-LBPRGKRZSA-N 2 0 277.368 2.717 20 5 CFBDRP CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1C)C1CC[NH2+]CC1 ZINC000347166717 380979816 /nfs/dbraw/zinc/97/98/16/380979816.db2.gz KWWZFOOACXPCAH-UHFFFAOYSA-N 2 0 291.395 2.867 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[NH2+]C[C@@H]1C ZINC000414948401 381638125 /nfs/dbraw/zinc/63/81/25/381638125.db2.gz XZKJENZXVYEUOR-GUTXKFCHSA-N 2 0 291.395 2.504 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000420418633 382403289 /nfs/dbraw/zinc/40/32/89/382403289.db2.gz XBWQOSKNUFIEHT-QWHCGFSZSA-N 2 0 277.368 2.553 20 5 CFBDRP CC[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1 ZINC000420415766 382403437 /nfs/dbraw/zinc/40/34/37/382403437.db2.gz VFRKJXDBEFWNDS-IUODEOHRSA-N 2 0 277.368 2.635 20 5 CFBDRP C[NH2+]C[C@H](C)C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000423275180 383055945 /nfs/dbraw/zinc/05/59/45/383055945.db2.gz MTRXLBSXCMWVIR-XHDPSFHLSA-N 2 0 291.395 2.762 20 5 CFBDRP Cc1c([C@H](C)[NH2+][C@H]2CCC[C@H]([NH3+])C2)cccc1[N+](=O)[O-] ZINC000423363779 383065155 /nfs/dbraw/zinc/06/51/55/383065155.db2.gz AKRHOXPSZPHHIJ-AVGNSLFASA-N 2 0 277.368 2.824 20 5 CFBDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000249376485 383342487 /nfs/dbraw/zinc/34/24/87/383342487.db2.gz KKBHGOHJJUPVDV-OLZOCXBDSA-N 2 0 277.368 2.587 20 5 CFBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](C)C[NH+](C)C ZINC000491558902 533384740 /nfs/dbraw/zinc/38/47/40/533384740.db2.gz HSBBDGKYMSNCCO-MQJVFOOVSA-N 2 0 291.395 2.785 20 5 CFBDRP C[C@@H](CC[NH3+])[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000414881194 533579753 /nfs/dbraw/zinc/57/97/53/533579753.db2.gz KSBAFDOLEBGERK-NSHDSACASA-N 2 0 289.335 2.682 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@H](C[NH3+])[C@H](C)C[C@@H]1C ZINC000422560816 394252813 /nfs/dbraw/zinc/25/28/13/394252813.db2.gz HRQFFFYSXGTTAC-ZLDLUXBVSA-N 2 0 291.395 2.708 20 5 CFBDRP Cc1c([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)C2)cccc1[N+](=O)[O-] ZINC000158175742 394355080 /nfs/dbraw/zinc/35/50/80/394355080.db2.gz GCAJITAUAGNHOW-KGLIPLIRSA-N 2 0 291.395 2.896 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(C[NH+](C)C)CC1 ZINC000349963466 163042389 /nfs/dbraw/zinc/04/23/89/163042389.db2.gz DADREGUAVKOCQZ-UHFFFAOYSA-N 2 0 291.395 2.677 20 5 CFBDRP CC[NH+]1CCC(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000044517619 175190601 /nfs/dbraw/zinc/19/06/01/175190601.db2.gz LRSITWMDQQCZMO-CYBMUJFWSA-N 2 0 291.395 2.977 20 5 CFBDRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000423513819 274949983 /nfs/dbraw/zinc/94/99/83/274949983.db2.gz RONNBCIIBFATLX-KFNAQCHYSA-N 2 0 289.379 2.689 20 5 CFBDRP CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[NH2+]CC1 ZINC000435392539 281235104 /nfs/dbraw/zinc/23/51/04/281235104.db2.gz WZTZYSOKQKOWLS-AWEZNQCLSA-N 2 0 277.368 2.559 20 5 CFBDRP CC(C)[NH2+]CCC[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000564823252 290236345 /nfs/dbraw/zinc/23/63/45/290236345.db2.gz XMWSFQXQQQRSDS-CQSZACIVSA-N 2 0 293.411 2.894 20 5 CFBDRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000387292905 324490175 /nfs/dbraw/zinc/49/01/75/324490175.db2.gz IMVRLZLBASWQSY-UHFFFAOYSA-N 2 0 279.384 2.805 20 5 CFBDRP C[C@H]1C[C@@H](C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)CC[NH2+]1 ZINC000414712750 534085812 /nfs/dbraw/zinc/08/58/12/534085812.db2.gz OGVQHBQIHYPKSV-STQMWFEESA-N 2 0 291.395 2.808 20 5 CFBDRP [NH3+]CCCC[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000414915299 534605819 /nfs/dbraw/zinc/60/58/19/534605819.db2.gz YYAJKZYXSGNNDU-UKRRQHHQSA-N 2 0 291.395 2.635 20 5 CFBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC[C@@H](C)[NH+](C)C ZINC000895292513 618514652 /nfs/dbraw/zinc/51/46/52/618514652.db2.gz CXNBLTOJWWELGH-JWAFFJSPSA-N 2 0 291.395 2.928 20 5 CFBDRP C[C@@H](CCNC/C=C\c1ccccc1[N+](=O)[O-])[NH+](C)C ZINC000895297780 618516657 /nfs/dbraw/zinc/51/66/57/618516657.db2.gz PDHZKPNYNNJQEG-WOLRVDTOSA-N 2 0 277.368 2.538 20 5 CFBDRP [NH3+][C@@H]1C[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000262333902 619843523 /nfs/dbraw/zinc/84/35/23/619843523.db2.gz SSDCJNVNYUOZGR-IAGOWNOFSA-N 2 0 297.358 2.872 20 5 CFBDRP C[C@H](C[NH2+][C@H]1CCC[C@H]([NH3+])C1)c1ccccc1[N+](=O)[O-] ZINC000902429732 621076672 /nfs/dbraw/zinc/07/66/72/621076672.db2.gz NOHZSBIMURPRFO-AGIUHOORSA-N 2 0 277.368 2.558 20 5 CFBDRP CC(C)(C[NH3+])C1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000903788979 621442279 /nfs/dbraw/zinc/44/22/79/621442279.db2.gz LXRVQNDOHGEIGO-UHFFFAOYSA-N 2 0 291.395 2.792 20 5 CFBDRP C[C@H]([NH2+]CC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc([N+](=O)[O-])cc1 ZINC000903988823 621500048 /nfs/dbraw/zinc/50/00/48/621500048.db2.gz XXTZSYDVWPSYNT-YPRXJGMQSA-N 2 0 289.379 2.776 20 5 CFBDRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000841081176 631332786 /nfs/dbraw/zinc/33/27/86/631332786.db2.gz VYEBWNQWNHKJKQ-JTQLQIEISA-N 2 0 285.775 2.855 20 5 CFBDRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000841078870 631332950 /nfs/dbraw/zinc/33/29/50/631332950.db2.gz HTVKEMVYSMNTHT-JTQLQIEISA-N 2 0 285.775 2.855 20 5 CFBDRP [NH3+]CC[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000843113624 631839026 /nfs/dbraw/zinc/83/90/26/631839026.db2.gz ZOKOGERWIZTVNH-LLVKDONJSA-N 2 0 297.786 2.809 20 5 CFBDRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000925492476 648183506 /nfs/dbraw/zinc/18/35/06/648183506.db2.gz IULWTGHGORXMNO-ZIAGYGMSSA-N 2 0 291.395 2.633 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)cc1[N+](=O)[O-] ZINC000925801144 648327302 /nfs/dbraw/zinc/32/73/02/648327302.db2.gz UZGFPCCYAZWWAD-UMVBOHGHSA-N 2 0 291.395 2.799 20 5 CFBDRP C[C@H](C[N+](C)(C)C)Oc1cccc([C@@H](C)[NH+](C)C)c1 ZINC001229620797 776859251 /nfs/dbraw/zinc/85/92/51/776859251.db2.gz DLNJSVPWQSCCLP-ZIAGYGMSSA-N 2 0 265.421 2.783 20 5 CFBDRP C[N@H+](CCCCCC[NH3+])Cc1cc(F)ccc1[N+](=O)[O-] ZINC000710693871 781335576 /nfs/dbraw/zinc/33/55/76/781335576.db2.gz NJHIRRUPGMVAEK-UHFFFAOYSA-N 2 0 283.347 2.685 20 5 CFBDRP C[NH+](C)CC1CC[NH+](Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000595298832 349596010 /nfs/dbraw/zinc/59/60/10/349596010.db2.gz SYZHFRZJKBTLFM-UHFFFAOYSA-N 2 0 295.358 2.508 20 5 CFBDRP C[NH+](C)CCC1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000056524189 346611164 /nfs/dbraw/zinc/61/11/64/346611164.db2.gz OREDKZQNXXJTIW-UHFFFAOYSA-N 2 0 291.395 2.759 20 5 CFBDRP CC(C)c1ccc(C[NH2+][C@H]2CCC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000591278584 349005970 /nfs/dbraw/zinc/00/59/70/349005970.db2.gz UDPYAUMVAMWGAG-AWEZNQCLSA-N 2 0 291.395 2.950 20 5 CFBDRP Cc1c([C@@H](C)[NH2+][C@@H]2CCC[NH2+]CC2)cccc1[N+](=O)[O-] ZINC000591578239 349032200 /nfs/dbraw/zinc/03/22/00/349032200.db2.gz DVUVURYFOYLHHC-CHWSQXEVSA-N 2 0 277.368 2.696 20 5 CFBDRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccccc1[N+](=O)[O-] ZINC000592471108 349126457 /nfs/dbraw/zinc/12/64/57/349126457.db2.gz YITYBBZAQICSAM-RFQIPJPRSA-N 2 0 289.379 2.634 20 5 CFBDRP C[NH2+]Cc1ccccc1C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000593319305 349246844 /nfs/dbraw/zinc/24/68/44/349246844.db2.gz URJKLYPCGBGNHD-UHFFFAOYSA-N 2 0 285.347 2.604 20 5 CFBDRP Cc1c([C@@H](C)[NH2+]CCC2CC[NH2+]CC2)cccc1[N+](=O)[O-] ZINC000593321351 349247216 /nfs/dbraw/zinc/24/72/16/349247216.db2.gz IPRQGKWSERTVNG-CYBMUJFWSA-N 2 0 291.395 2.944 20 5 CFBDRP Cc1ccc(C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])cc1[N+](=O)[O-] ZINC000414792755 233354034 /nfs/dbraw/zinc/35/40/34/233354034.db2.gz CUDONAIGTPKWSS-UONOGXRCSA-N 2 0 277.368 2.510 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+]CC2CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000297440426 200191139 /nfs/dbraw/zinc/19/11/39/200191139.db2.gz PRVAVZPHFYCHIJ-LBPRGKRZSA-N 2 0 277.368 2.553 20 5 CFBDRP Cc1c([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[NH2+]C2)cccc1[N+](=O)[O-] ZINC000423221839 238286377 /nfs/dbraw/zinc/28/63/77/238286377.db2.gz YJRCWXQZIJTSAT-IHRRRGAJSA-N 2 0 291.395 2.942 20 5 CFBDRP Cc1c([C@@H](C)[NH2+]C[C@@]2(C)CCC[NH2+]C2)cccc1[N+](=O)[O-] ZINC000423346301 238397103 /nfs/dbraw/zinc/39/71/03/238397103.db2.gz ZSJZEHACFUJNJU-CJNGLKHVSA-N 2 0 291.395 2.944 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000459729069 245286750 /nfs/dbraw/zinc/28/67/50/245286750.db2.gz DFYQDORMSYZQNV-CQSZACIVSA-N 2 0 291.395 2.725 20 5 CFBDRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000037648975 372685077 /nfs/dbraw/zinc/68/50/77/372685077.db2.gz WGFMZHYTQZWONB-QWHCGFSZSA-N 2 0 289.379 2.730 20 5 CFBDRP CCC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC[NH2+]CC1 ZINC000037653862 372687308 /nfs/dbraw/zinc/68/73/08/372687308.db2.gz RJLLJODBMBXJAI-UHFFFAOYSA-N 2 0 277.368 2.559 20 5 CFBDRP C[NH+](C)CCCC[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000084439987 374776033 /nfs/dbraw/zinc/77/60/33/374776033.db2.gz JMQRBVBALAWLDE-UHFFFAOYSA-N 2 0 285.775 2.680 20 5 CFBDRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000332344260 378751055 /nfs/dbraw/zinc/75/10/55/378751055.db2.gz XTTJKWJQYOMSKJ-LYRGGWFBSA-N 2 0 289.379 2.560 20 5 CFBDRP C[NH2+]CC1CC[NH+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000347059430 380914052 /nfs/dbraw/zinc/91/40/52/380914052.db2.gz WYRAACJSSZLSIT-XQRVVYSFSA-N 2 0 289.379 2.539 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000414960943 381656339 /nfs/dbraw/zinc/65/63/39/381656339.db2.gz AWGPNBFANWETPB-AWEZNQCLSA-N 2 0 277.368 2.525 20 5 CFBDRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000415020862 381714831 /nfs/dbraw/zinc/71/48/31/381714831.db2.gz XXUUGAJPTOFWRH-JTQLQIEISA-N 2 0 285.775 2.855 20 5 CFBDRP CC[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000414994742 381687661 /nfs/dbraw/zinc/68/76/61/381687661.db2.gz VESOBVAONWEIOB-VHDGCEQUSA-N 2 0 291.395 2.633 20 5 CFBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC[NH2+]C1CC1 ZINC000415066470 381751954 /nfs/dbraw/zinc/75/19/54/381751954.db2.gz ITQSVBAAXVNXPC-ZDUSSCGKSA-N 2 0 291.395 2.648 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCC[NH2+]C1 ZINC000415069409 381752960 /nfs/dbraw/zinc/75/29/60/381752960.db2.gz GDHHYVQTWFGPJL-UKRRQHHQSA-N 2 0 291.395 2.648 20 5 CFBDRP CC[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1cccc([N+](=O)[O-])c1 ZINC000420397867 382398291 /nfs/dbraw/zinc/39/82/91/382398291.db2.gz GMYYAEPGXBVSSA-SWLSCSKDSA-N 2 0 277.368 2.635 20 5 CFBDRP CC[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1cccc([N+](=O)[O-])c1 ZINC000420397865 382398364 /nfs/dbraw/zinc/39/83/64/382398364.db2.gz GMYYAEPGXBVSSA-IUODEOHRSA-N 2 0 277.368 2.635 20 5 CFBDRP CC[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1 ZINC000420415768 382403840 /nfs/dbraw/zinc/40/38/40/382403840.db2.gz VFRKJXDBEFWNDS-SWLSCSKDSA-N 2 0 277.368 2.635 20 5 CFBDRP CN(CCC[NH+]1CCCCC1)Cc1ccccc1[N+](=O)[O-] ZINC000193469083 382720114 /nfs/dbraw/zinc/72/01/14/382720114.db2.gz YCJBKFILIZGIBQ-UHFFFAOYSA-N 2 0 291.395 2.903 20 5 CFBDRP CC[NH2+]CCC[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000578756792 382951351 /nfs/dbraw/zinc/95/13/51/382951351.db2.gz PXLROJQJFRRDMA-ZDUSSCGKSA-N 2 0 279.384 2.505 20 5 CFBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCC[C@@H]([NH3+])C1 ZINC000423471499 383108686 /nfs/dbraw/zinc/10/86/86/383108686.db2.gz MHULIVHHCNEOKZ-VNHYZAJKSA-N 2 0 291.395 2.633 20 5 CFBDRP C[NH+](C)[C@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000277154732 384215844 /nfs/dbraw/zinc/21/58/44/384215844.db2.gz JVBXAOVDPOMTMD-HNNXBMFYSA-N 2 0 291.395 2.553 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCC[C@H]1CC[NH3+] ZINC000352535569 394015396 /nfs/dbraw/zinc/01/53/96/394015396.db2.gz SFGGSCNCWRVOER-AWEZNQCLSA-N 2 0 277.368 2.607 20 5 CFBDRP C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[NH2+]C1 ZINC000423218620 287051442 /nfs/dbraw/zinc/05/14/42/287051442.db2.gz SCVZWSGULLVIBF-OUCADQQQSA-N 2 0 277.368 2.634 20 5 CFBDRP CC[NH+]1CCC(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000044517763 175191072 /nfs/dbraw/zinc/19/10/72/175191072.db2.gz JYZNMHNUDNLLSB-UHFFFAOYSA-N 2 0 291.395 2.725 20 5 CFBDRP CCC[N@H+](CCc1ccc([N+](=O)[O-])cc1)C1CC[NH2+]CC1 ZINC000037539303 276000194 /nfs/dbraw/zinc/00/01/94/276000194.db2.gz LFVZEOBBIOMNSG-UHFFFAOYSA-N 2 0 291.395 2.601 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000415039365 279275001 /nfs/dbraw/zinc/27/50/01/279275001.db2.gz NYEYGIPEAXAIMD-VNHYZAJKSA-N 2 0 291.395 2.633 20 5 CFBDRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1ccccc1[N+](=O)[O-] ZINC000519564312 281309068 /nfs/dbraw/zinc/30/90/68/281309068.db2.gz WJVCEARTPRKKGH-QJPTWQEYSA-N 2 0 263.341 2.515 20 5 CFBDRP [NH3+]CCC[N@@H+](Cc1ccccc1[N+](=O)[O-])CC1CCCC1 ZINC000352494982 303378140 /nfs/dbraw/zinc/37/81/40/303378140.db2.gz HQRCKVKCHBXORA-UHFFFAOYSA-N 2 0 291.395 2.936 20 5 CFBDRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1ccc([N+](=O)[O-])cc1 ZINC000583441475 325288409 /nfs/dbraw/zinc/28/84/09/325288409.db2.gz KDZIMPICUYOZRG-LBPRGKRZSA-N 2 0 285.347 2.904 20 5 CFBDRP C[C@@H](C[NH3+])C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000414869762 533772302 /nfs/dbraw/zinc/77/23/02/533772302.db2.gz BFODNPRSUFQWIV-NSHDSACASA-N 2 0 289.335 2.539 20 5 CFBDRP C[C@H]([NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000423455968 533882818 /nfs/dbraw/zinc/88/28/18/533882818.db2.gz GHICSZPRPBHCBI-OUCADQQQSA-N 2 0 277.368 2.763 20 5 CFBDRP Cc1c([C@@H](C)[NH2+]CC[C@H]2CCC[NH2+]C2)cccc1[N+](=O)[O-] ZINC000423256906 533943099 /nfs/dbraw/zinc/94/30/99/533943099.db2.gz GONIVCIOOUNHBW-ZIAGYGMSSA-N 2 0 291.395 2.944 20 5 CFBDRP CC(C)c1ccc(C[NH2+]CC[C@H]2CC[NH2+]C2)cc1[N+](=O)[O-] ZINC000414828300 528100014 /nfs/dbraw/zinc/10/00/14/528100014.db2.gz IPIFCPBOWIQLRB-CYBMUJFWSA-N 2 0 291.395 2.807 20 5 CFBDRP CC(C)c1ccc(C[NH2+]CC[C@@H]2CC[NH2+]C2)cc1[N+](=O)[O-] ZINC000414828302 528100958 /nfs/dbraw/zinc/10/09/58/528100958.db2.gz IPIFCPBOWIQLRB-ZDUSSCGKSA-N 2 0 291.395 2.807 20 5 CFBDRP CC[C@@H]([NH2+][C@@H](C)CCC[NH3+])c1cccc([N+](=O)[O-])c1 ZINC000422838997 529199329 /nfs/dbraw/zinc/19/93/29/529199329.db2.gz PKJKISYAYZYGBQ-SMDDNHRTSA-N 2 0 265.357 2.763 20 5 CFBDRP C[NH+]1CCC(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000049963760 618054595 /nfs/dbraw/zinc/05/45/95/618054595.db2.gz FOWWAUNNHMJOKW-UHFFFAOYSA-N 2 0 297.786 2.680 20 5 CFBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC[C@H](C)[NH+](C)C ZINC000895292519 618514663 /nfs/dbraw/zinc/51/46/63/618514663.db2.gz CXNBLTOJWWELGH-UELRPHRMSA-N 2 0 291.395 2.928 20 5 CFBDRP CC[C@H]([NH2+][C@H]1C[C@H]([NH3+])C12CCC2)c1cccc([N+](=O)[O-])c1 ZINC000925540467 618898981 /nfs/dbraw/zinc/89/89/81/618898981.db2.gz CKEMFCYNTDTHFP-KKUMJFAQSA-N 2 0 289.379 2.905 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925876444 619196699 /nfs/dbraw/zinc/19/66/99/619196699.db2.gz XZXBJRXKSYXLDD-NFAWXSAZSA-N 2 0 291.395 2.633 20 5 CFBDRP [NH3+][C@H]1C[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000262333905 619843757 /nfs/dbraw/zinc/84/37/57/619843757.db2.gz SSDCJNVNYUOZGR-IRXDYDNUSA-N 2 0 297.358 2.872 20 5 CFBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1([NH3+])CC1 ZINC000902413934 621084421 /nfs/dbraw/zinc/08/44/21/621084421.db2.gz PYRWNVSNPPMLBN-LLVKDONJSA-N 2 0 295.408 2.546 20 5 CFBDRP COc1cc([C@@H](C)[NH2+]CCCC[NH+](C)C)cc([N+](=O)[O-])c1 ZINC000903083853 621246305 /nfs/dbraw/zinc/24/63/05/621246305.db2.gz OWSSEVHLEAOZKO-GFCCVEGCSA-N 2 0 295.383 2.596 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000903757906 621438608 /nfs/dbraw/zinc/43/86/08/621438608.db2.gz IMYAXQAAURUINM-UONOGXRCSA-N 2 0 291.395 2.944 20 5 CFBDRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000903978705 621494342 /nfs/dbraw/zinc/49/43/42/621494342.db2.gz LIIGRFZHFKDXFM-ZYHUDNBSSA-N 2 0 297.786 2.583 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H](CC[NH3+])C1 ZINC000923480478 626475864 /nfs/dbraw/zinc/47/58/64/626475864.db2.gz HKDCPDWQEGZZGW-STQMWFEESA-N 2 0 277.368 2.635 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H](C[NH3+])[C@@H](C)C1 ZINC000923494807 626477017 /nfs/dbraw/zinc/47/70/17/626477017.db2.gz OVTFLFZYAWQPHT-MELADBBJSA-N 2 0 291.395 2.881 20 5 CFBDRP CC1(C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CC[NH2+]CC1 ZINC000841056028 631324391 /nfs/dbraw/zinc/32/43/91/631324391.db2.gz AKXJDQJQRHJBSN-UHFFFAOYSA-N 2 0 297.786 2.728 20 5 CFBDRP C[C@@H]([NH2+]CCCCCC[NH3+])c1cccc([N+](=O)[O-])c1 ZINC000843342382 631932707 /nfs/dbraw/zinc/93/27/07/631932707.db2.gz LVOBOVPFBHDPCI-GFCCVEGCSA-N 2 0 265.357 2.765 20 5 CFBDRP C[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1ccc([N+](=O)[O-])cc1 ZINC000817946917 632749737 /nfs/dbraw/zinc/74/97/37/632749737.db2.gz HTJQUDVLWXUONR-CYBMUJFWSA-N 2 0 299.374 2.947 20 5 CFBDRP CC1(C)C[C@@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)c2cc([N+](=O)[O-])ccc21 ZINC000873251097 642097552 /nfs/dbraw/zinc/09/75/52/642097552.db2.gz SXLBRDZQNJUHBJ-JRPNMDOOSA-N 2 0 289.379 2.644 20 5 CFBDRP Cc1c([C@@H](C)[NH2+][C@@H](C)C2CC[NH2+]CC2)cccc1[N+](=O)[O-] ZINC000873272959 642113728 /nfs/dbraw/zinc/11/37/28/642113728.db2.gz XXALLCINJNTRAX-QWHCGFSZSA-N 2 0 291.395 2.942 20 5 CFBDRP C[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C1CCC([NH3+])CC1 ZINC000091847001 650909969 /nfs/dbraw/zinc/90/99/69/650909969.db2.gz HUYDULLTOMSAND-UHFFFAOYSA-N 2 0 297.786 2.950 20 5 CFBDRP C[C@@H](C[N+](C)(C)C)O[C@@H](CC[NH+](C)C)c1ccccc1 ZINC001224133275 775108042 /nfs/dbraw/zinc/10/80/42/775108042.db2.gz KNYXFJAFUPYSDL-RDJZCZTQSA-N 2 0 279.448 2.791 20 5 CFBDRP C[C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1OCC[N+](C)(C)C ZINC001224772036 775269680 /nfs/dbraw/zinc/26/96/80/775269680.db2.gz WIAAUBQJHYNSRQ-FUHWJXTLSA-N 2 0 291.459 2.620 20 5 CFBDRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000594508478 349435222 /nfs/dbraw/zinc/43/52/22/349435222.db2.gz CFDWKMSKXOXVOD-SLEUVZQESA-N 2 0 277.368 2.586 20 5 CFBDRP C[N@@H+]1CC[C@@]2(C1)CCCN(Cc1cccc([N+](=O)[O-])c1)C2 ZINC000595507478 349646035 /nfs/dbraw/zinc/64/60/35/349646035.db2.gz OJTABAVGLIFQNF-MRXNPFEDSA-N 2 0 289.379 2.513 20 5 CFBDRP C[C@@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]1CC[NH3+] ZINC000404314095 348590126 /nfs/dbraw/zinc/59/01/26/348590126.db2.gz AFADDNVFJLPFQQ-TZMCWYRMSA-N 2 0 277.368 2.544 20 5 CFBDRP C[C@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])[C@H]1CC[NH3+] ZINC000404314093 348590724 /nfs/dbraw/zinc/59/07/24/348590724.db2.gz AFADDNVFJLPFQQ-JSGCOSHPSA-N 2 0 277.368 2.544 20 5 CFBDRP C[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H]1CC[NH3+] ZINC000404444379 348592265 /nfs/dbraw/zinc/59/22/65/348592265.db2.gz WJUJHJLWKXZCNN-IUODEOHRSA-N 2 0 277.368 2.544 20 5 CFBDRP CC[C@H]([NH2+]CCC1(C[NH3+])CC1)c1cccc([N+](=O)[O-])c1 ZINC000593318906 349246334 /nfs/dbraw/zinc/24/63/34/349246334.db2.gz HJFHUHSQYNQKRB-AWEZNQCLSA-N 2 0 277.368 2.765 20 5 CFBDRP Cc1c([C@@H](C)[NH2+]CCC2(C[NH3+])CC2)cccc1[N+](=O)[O-] ZINC000593319838 349246741 /nfs/dbraw/zinc/24/67/41/349246741.db2.gz PRVFELMVETXKFQ-GFCCVEGCSA-N 2 0 277.368 2.683 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000414904494 233393750 /nfs/dbraw/zinc/39/37/50/233393750.db2.gz LTBGJVDSHCKAGB-UKRRQHHQSA-N 2 0 291.395 2.648 20 5 CFBDRP CC[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000271818877 191347141 /nfs/dbraw/zinc/34/71/41/191347141.db2.gz BWVIYMZICNSBJB-MRXNPFEDSA-N 2 0 289.379 2.897 20 5 CFBDRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000422915027 237341495 /nfs/dbraw/zinc/34/14/95/237341495.db2.gz AKXMFHOWFWTCFG-HOCLYGCPSA-N 2 0 291.395 2.635 20 5 CFBDRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000422916232 237346860 /nfs/dbraw/zinc/34/68/60/237346860.db2.gz CXFRIXISEYZQOA-STQMWFEESA-N 2 0 279.384 2.633 20 5 CFBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000423274080 238331428 /nfs/dbraw/zinc/33/14/28/238331428.db2.gz JSZNMESEKZCLBB-YUELXQCFSA-N 2 0 291.395 2.633 20 5 CFBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000423278195 238335939 /nfs/dbraw/zinc/33/59/39/238335939.db2.gz QTEUHHUURXDISM-KGLIPLIRSA-N 2 0 291.395 2.505 20 5 CFBDRP C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@@H]1CCC[NH2+]CC1 ZINC000435433403 240314449 /nfs/dbraw/zinc/31/44/49/240314449.db2.gz NKNYRDBJOKGDFJ-KEDPEKRHSA-N 2 0 289.379 2.682 20 5 CFBDRP C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@@H]1CCC[NH2+]CC1 ZINC000435433406 240315234 /nfs/dbraw/zinc/31/52/34/240315234.db2.gz NKNYRDBJOKGDFJ-ZQMJAJRESA-N 2 0 289.379 2.682 20 5 CFBDRP C[NH+](C)CCC1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000056522003 373567315 /nfs/dbraw/zinc/56/73/15/373567315.db2.gz MJINIDLRUZLLQO-UHFFFAOYSA-N 2 0 291.395 2.759 20 5 CFBDRP O=[N+]([O-])c1ccc(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)cc1 ZINC000063197929 373795574 /nfs/dbraw/zinc/79/55/74/373795574.db2.gz RXFGMESGBHXEDW-MRXNPFEDSA-N 2 0 289.379 2.559 20 5 CFBDRP C[NH2+]CCC1CC[NH+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000070189030 374143686 /nfs/dbraw/zinc/14/36/86/374143686.db2.gz CIGMWAAYTRYBJD-ZDUSSCGKSA-N 2 0 291.395 2.977 20 5 CFBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(CC[NH3+])CC1 ZINC000070187472 374144123 /nfs/dbraw/zinc/14/41/23/374144123.db2.gz CWZXCFKGFGQSFD-GFCCVEGCSA-N 2 0 277.368 2.717 20 5 CFBDRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000336817569 380681329 /nfs/dbraw/zinc/68/13/29/380681329.db2.gz QWIVQKQDLRLAHW-RYUDHWBXSA-N 2 0 265.357 2.763 20 5 CFBDRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000414181083 381569109 /nfs/dbraw/zinc/56/91/09/381569109.db2.gz MMLJJJYWOUBHIY-UONOGXRCSA-N 2 0 291.395 2.977 20 5 CFBDRP Cc1ccc(C[NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)cc1[N+](=O)[O-] ZINC000414984866 381678637 /nfs/dbraw/zinc/67/86/37/381678637.db2.gz ATAIERZETNWZJQ-TZMCWYRMSA-N 2 0 277.368 2.510 20 5 CFBDRP [NH3+][C@@H]1CCC[C@H](C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000414986969 381681216 /nfs/dbraw/zinc/68/12/16/381681216.db2.gz CYTNQOVJQJVIBE-ZDSVCRJJSA-N 2 0 289.379 2.715 20 5 CFBDRP [NH3+][C@@H]1CCC[C@@H](C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000414986966 381681749 /nfs/dbraw/zinc/68/17/49/381681749.db2.gz CYTNQOVJQJVIBE-YFOKADDASA-N 2 0 289.379 2.715 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCC[NH2+]C1 ZINC000415069407 381754612 /nfs/dbraw/zinc/75/46/12/381754612.db2.gz GDHHYVQTWFGPJL-HIFRSBDPSA-N 2 0 291.395 2.648 20 5 CFBDRP C[NH2+]CC1CC[NH+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000420303155 382353961 /nfs/dbraw/zinc/35/39/61/382353961.db2.gz WYSLQNMZVQLYBP-ZDUSSCGKSA-N 2 0 291.395 2.896 20 5 CFBDRP C[NH2+]CC1CC[NH+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000420303153 382354543 /nfs/dbraw/zinc/35/45/43/382354543.db2.gz WYSLQNMZVQLYBP-CYBMUJFWSA-N 2 0 291.395 2.896 20 5 CFBDRP O=[N+]([O-])c1cccc(C[N@H+](CC[C@H]2CC[NH2+]C2)C2CC2)c1 ZINC000420369604 382391300 /nfs/dbraw/zinc/39/13/00/382391300.db2.gz XUSOCEDMDDGRLX-CYBMUJFWSA-N 2 0 289.379 2.559 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1CN(C)CC[C@H]([NH3+])C(C)C ZINC000346673311 382464871 /nfs/dbraw/zinc/46/48/71/382464871.db2.gz IAMLOLVUOBEXLR-HNNXBMFYSA-N 2 0 279.384 2.708 20 5 CFBDRP CC[N@H+](C)CCNc1cc(C)[nH+]c2ccc([N+](=O)[O-])cc12 ZINC000228484499 382847067 /nfs/dbraw/zinc/84/70/67/382847067.db2.gz VECUOWRVYRYSAI-UHFFFAOYSA-N 2 0 288.351 2.815 20 5 CFBDRP Cc1c(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])cccc1[N+](=O)[O-] ZINC000231883874 382867366 /nfs/dbraw/zinc/86/73/66/382867366.db2.gz JDMYSPCJPWCFGL-OCCSQVGLSA-N 2 0 277.368 2.510 20 5 CFBDRP CC[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000423497237 383121366 /nfs/dbraw/zinc/12/13/66/383121366.db2.gz YNBOPMOWVJKKIP-WHOFXGATSA-N 2 0 277.368 2.763 20 5 CFBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000423477575 383111615 /nfs/dbraw/zinc/11/16/15/383111615.db2.gz KBGLLELMXKKZGP-HIFRSBDPSA-N 2 0 291.395 2.648 20 5 CFBDRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000423546506 394295507 /nfs/dbraw/zinc/29/55/07/394295507.db2.gz FJTZGZXUZVBVOB-GFCCVEGCSA-N 2 0 275.352 2.555 20 5 CFBDRP CC(C)[NH+]1CCC([NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000040675858 174373327 /nfs/dbraw/zinc/37/33/27/174373327.db2.gz XAUXNAISHAQBAM-UHFFFAOYSA-N 2 0 291.395 2.600 20 5 CFBDRP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000044534129 175196946 /nfs/dbraw/zinc/19/69/46/175196946.db2.gz YQKQOUWAJLXWJN-CJNGLKHVSA-N 2 0 291.395 2.977 20 5 CFBDRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1ccc([N+](=O)[O-])cc1 ZINC000423372126 279536643 /nfs/dbraw/zinc/53/66/43/279536643.db2.gz GUICYSDYIZOIET-UHTWSYAYSA-N 2 0 263.341 2.515 20 5 CFBDRP Cc1ccc(C[NH2+]Cc2ccc(C[NH3+])cc2)cc1[N+](=O)[O-] ZINC000566855477 290422707 /nfs/dbraw/zinc/42/27/07/290422707.db2.gz HCLJWJYBKUZZPO-UHFFFAOYSA-N 2 0 285.347 2.652 20 5 CFBDRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1ccc([N+](=O)[O-])cc1 ZINC000583441474 325288307 /nfs/dbraw/zinc/28/83/07/325288307.db2.gz KDZIMPICUYOZRG-GFCCVEGCSA-N 2 0 285.347 2.904 20 5 CFBDRP C[C@]1(C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])CCC[NH2+]C1 ZINC000414913812 534175734 /nfs/dbraw/zinc/17/57/34/534175734.db2.gz WYBLLWGKGXWVNY-HQQUCIOCSA-N 2 0 289.379 2.587 20 5 CFBDRP [NH3+]CC[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000261756934 527194607 /nfs/dbraw/zinc/19/46/07/527194607.db2.gz COXPQNWXPNRHNR-LLVKDONJSA-N 2 0 297.786 2.809 20 5 CFBDRP CC(C)([NH3+])C[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000414808841 527258455 /nfs/dbraw/zinc/25/84/55/527258455.db2.gz UKBYYCGQQTWFRQ-JSGCOSHPSA-N 2 0 291.395 2.633 20 5 CFBDRP [NH3+][C@@H]1C[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000262333908 618198624 /nfs/dbraw/zinc/19/86/24/618198624.db2.gz SSDCJNVNYUOZGR-SJORKVTESA-N 2 0 297.358 2.872 20 5 CFBDRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C1 ZINC000925628378 618355539 /nfs/dbraw/zinc/35/55/39/618355539.db2.gz DWYDCHXVPOEDJY-ZIAGYGMSSA-N 2 0 291.395 2.633 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC[C@H](C)[NH+](C)C ZINC000895292253 618514836 /nfs/dbraw/zinc/51/48/36/618514836.db2.gz ALKHFBLGOQAYAZ-KGLIPLIRSA-N 2 0 293.411 2.846 20 5 CFBDRP C[C@@H](CCNC/C=C/c1ccccc1[N+](=O)[O-])[NH+](C)C ZINC000895297777 618516699 /nfs/dbraw/zinc/51/66/99/618516699.db2.gz PDHZKPNYNNJQEG-CFNZNRNTSA-N 2 0 277.368 2.538 20 5 CFBDRP CC[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2)c1cccc([N+](=O)[O-])c1 ZINC000925540481 618899206 /nfs/dbraw/zinc/89/92/06/618899206.db2.gz CKEMFCYNTDTHFP-RRFJBIMHSA-N 2 0 289.379 2.905 20 5 CFBDRP CC[NH+]1CCC([NH2+]C[C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000897466666 620177442 /nfs/dbraw/zinc/17/74/42/620177442.db2.gz ZBUXEAYUGSTYBP-CYBMUJFWSA-N 2 0 291.395 2.772 20 5 CFBDRP C[C@H](C[NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1ccccc1[N+](=O)[O-] ZINC000902430046 621076798 /nfs/dbraw/zinc/07/67/98/621076798.db2.gz NOHZSBIMURPRFO-JHJVBQTASA-N 2 0 277.368 2.558 20 5 CFBDRP CC(C)c1ccc(C[NH2+]CCC(C)(C)[NH3+])cc1[N+](=O)[O-] ZINC000903940694 621481798 /nfs/dbraw/zinc/48/17/98/621481798.db2.gz AFJOZFFFQUMWCO-UHFFFAOYSA-N 2 0 279.384 2.935 20 5 CFBDRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000841079405 621502894 /nfs/dbraw/zinc/50/28/94/621502894.db2.gz LZSOAKLGDKVXTK-JTQLQIEISA-N 2 0 285.775 2.855 20 5 CFBDRP C[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC[C@@H]1C[NH3+] ZINC000904411587 621592281 /nfs/dbraw/zinc/59/22/81/621592281.db2.gz NTKRBWHJMUWSJR-WDEREUQCSA-N 2 0 297.786 2.665 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000923522688 626478710 /nfs/dbraw/zinc/47/87/10/626478710.db2.gz YQVYWRALKAVFIR-MELADBBJSA-N 2 0 289.379 2.506 20 5 CFBDRP [NH3+]CCCCCC[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000843128565 631848150 /nfs/dbraw/zinc/84/81/50/631848150.db2.gz KGAIOMZSQXFIBJ-UHFFFAOYSA-N 2 0 285.775 2.857 20 5 CFBDRP C[C@@H]([NH2+][C@H](C)C1CC[NH2+]CC1)c1ccc([N+](=O)[O-])cc1 ZINC000873266364 642109164 /nfs/dbraw/zinc/10/91/64/642109164.db2.gz WFNOWAWZLVOKSA-VXGBXAGGSA-N 2 0 277.368 2.634 20 5 CFBDRP Cc1c([C@H](C)[NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)cccc1[N+](=O)[O-] ZINC000925795624 648326242 /nfs/dbraw/zinc/32/62/42/648326242.db2.gz HHQRUCKITCEFGU-KWCYVHTRSA-N 2 0 291.395 2.799 20 5 CFBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000723888166 770707060 /nfs/dbraw/zinc/70/70/60/770707060.db2.gz XHJJIRSVRURSRQ-JHJVBQTASA-N 2 0 277.368 2.573 20 5 CFBDRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1OCC[N+](C)(C)C ZINC001224776494 775271744 /nfs/dbraw/zinc/27/17/44/775271744.db2.gz WKZJBSWJGAMICF-AEFFLSMTSA-N 2 0 291.459 2.620 20 5 CFBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC[C@H](C)[NH3+] ZINC000423223087 529418216 /nfs/dbraw/zinc/41/82/16/529418216.db2.gz DTUUUTGYBJECHT-NWDGAFQWSA-N 2 0 297.424 2.792 20 5 CFBDRP CC[C@H]([NH2+][C@H](C)CCC[NH3+])c1cccc([N+](=O)[O-])c1 ZINC000422838996 529664584 /nfs/dbraw/zinc/66/45/84/529664584.db2.gz PKJKISYAYZYGBQ-RISCZKNCSA-N 2 0 265.357 2.763 20 5 CFBDRP C[C@@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000414170022 233185952 /nfs/dbraw/zinc/18/59/52/233185952.db2.gz BLPUCVHDNPXRRD-ZIAGYGMSSA-N 2 0 291.395 2.977 20 5 CFBDRP CC(C)c1ccc(C[NH2+]CCC2(C[NH3+])CC2)cc1[N+](=O)[O-] ZINC000593314848 349245722 /nfs/dbraw/zinc/24/57/22/349245722.db2.gz GGXNMHNHEFGRKJ-UHFFFAOYSA-N 2 0 291.395 2.937 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+]CCC2(C[NH3+])CC2)cc1[N+](=O)[O-] ZINC000593318219 349246735 /nfs/dbraw/zinc/24/67/35/349246735.db2.gz BOGTVGXEJWBMQH-GFCCVEGCSA-N 2 0 277.368 2.683 20 5 CFBDRP C[C@H]([NH2+]CCC1CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000593322427 349247293 /nfs/dbraw/zinc/24/72/93/349247293.db2.gz MVYGREZEDPSKEP-LBPRGKRZSA-N 2 0 277.368 2.635 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000414794471 233353361 /nfs/dbraw/zinc/35/33/61/233353361.db2.gz FRZQUANUPMYPGE-IUODEOHRSA-N 2 0 277.368 2.510 20 5 CFBDRP O=[N+]([O-])c1ccccc1/C=C/C[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000414849357 233377147 /nfs/dbraw/zinc/37/71/47/233377147.db2.gz LSMPJBRAWFTOPK-BTKRWWFXSA-N 2 0 289.379 2.587 20 5 CFBDRP C[C@@H]([NH3+])C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000110651296 186311565 /nfs/dbraw/zinc/31/15/65/186311565.db2.gz PMKKFJVGJOAIAG-SNVBAGLBSA-N 2 0 297.786 2.807 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1C[C@@H]([NH3+])C1(C)C ZINC000603431708 351163077 /nfs/dbraw/zinc/16/30/77/351163077.db2.gz GJNPGBZDGTWTRA-GDLCADMTSA-N 2 0 277.368 2.680 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@@H](C)C[C@H](C)[NH3+])cc1[N+](=O)[O-] ZINC000422918356 237343718 /nfs/dbraw/zinc/34/37/18/237343718.db2.gz HDMGAEPAOULAQY-SRVKXCTJSA-N 2 0 265.357 2.680 20 5 CFBDRP Cc1c([C@H](C)[NH2+]CC[C@H]2CCC[NH2+]C2)cccc1[N+](=O)[O-] ZINC000423256905 238311605 /nfs/dbraw/zinc/31/16/05/238311605.db2.gz GONIVCIOOUNHBW-UONOGXRCSA-N 2 0 291.395 2.944 20 5 CFBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000423274078 238331716 /nfs/dbraw/zinc/33/17/16/238331716.db2.gz JSZNMESEKZCLBB-SNPRPXQTSA-N 2 0 291.395 2.633 20 5 CFBDRP C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@H]1CCC[NH2+]CC1 ZINC000435433404 240313915 /nfs/dbraw/zinc/31/39/15/240313915.db2.gz NKNYRDBJOKGDFJ-PKYBCLHXSA-N 2 0 289.379 2.682 20 5 CFBDRP O=[N+]([O-])c1ccccc1C[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000063197930 373794659 /nfs/dbraw/zinc/79/46/59/373794659.db2.gz CQRMMPXAEUINOB-HNNXBMFYSA-N 2 0 289.379 2.559 20 5 CFBDRP C[NH2+]CCC1CC[NH+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000070188893 374143859 /nfs/dbraw/zinc/14/38/59/374143859.db2.gz DXOBIGOUXYPTCR-CYBMUJFWSA-N 2 0 291.395 2.977 20 5 CFBDRP CC[NH2+]CC1CC[NH+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000129870706 377483756 /nfs/dbraw/zinc/48/37/56/377483756.db2.gz UVXNJNPFJFSZJU-CYBMUJFWSA-N 2 0 291.395 2.977 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1CN[C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000368318718 380990232 /nfs/dbraw/zinc/99/02/32/380990232.db2.gz NSFDMRABPKPEGP-LSDHHAIUSA-N 2 0 289.379 2.620 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[NH2+]C[C@@H]1C ZINC000414948402 381638292 /nfs/dbraw/zinc/63/82/92/381638292.db2.gz XZKJENZXVYEUOR-GZBFAFLISA-N 2 0 291.395 2.504 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)CCC[NH3+] ZINC000415017462 381711704 /nfs/dbraw/zinc/71/17/04/381711704.db2.gz FODVMBKSGROBQF-QWHCGFSZSA-N 2 0 279.384 2.633 20 5 CFBDRP C[NH2+]CCC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000346693264 382476416 /nfs/dbraw/zinc/47/64/16/382476416.db2.gz LUKBOEOFKUISGV-UHFFFAOYSA-N 2 0 291.395 2.725 20 5 CFBDRP CC(C)[N@H+](C)CCCN[C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000221923879 382800394 /nfs/dbraw/zinc/80/03/94/382800394.db2.gz NMVYKVRERXZIEH-CYBMUJFWSA-N 2 0 279.384 2.976 20 5 CFBDRP C[C@@H](CCC[NH3+])[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000423045445 383028670 /nfs/dbraw/zinc/02/86/70/383028670.db2.gz SBKXNJAFTAAEOH-JTQLQIEISA-N 2 0 285.775 2.508 20 5 CFBDRP CC[C@H]([NH2+][C@@H]1CC[C@@H](C[NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000423497234 383121542 /nfs/dbraw/zinc/12/15/42/383121542.db2.gz YNBOPMOWVJKKIP-KYOSRNDESA-N 2 0 277.368 2.763 20 5 CFBDRP CC[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000423497235 383121550 /nfs/dbraw/zinc/12/15/50/383121550.db2.gz YNBOPMOWVJKKIP-LNSITVRQSA-N 2 0 277.368 2.763 20 5 CFBDRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000423438664 383096044 /nfs/dbraw/zinc/09/60/44/383096044.db2.gz ROYVXBNNJBQXIW-STQMWFEESA-N 2 0 279.384 2.633 20 5 CFBDRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000249382673 383342134 /nfs/dbraw/zinc/34/21/34/383342134.db2.gz UAIZWNOYVZCUQP-CHWSQXEVSA-N 2 0 277.368 2.587 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCC[C@@H]1CC[NH3+] ZINC000352535570 394015453 /nfs/dbraw/zinc/01/54/53/394015453.db2.gz SFGGSCNCWRVOER-CQSZACIVSA-N 2 0 277.368 2.607 20 5 CFBDRP C[NH+](C)CCCC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000278835021 394064250 /nfs/dbraw/zinc/06/42/50/394064250.db2.gz UJLPKOYDBGDGQT-INIZCTEOSA-N 2 0 291.395 2.904 20 5 CFBDRP C[C@@H]1C[C@@H]([NH2+]C/C=C\c2ccccc2[N+](=O)[O-])CC[N@@H+]1C ZINC000344610618 162081264 /nfs/dbraw/zinc/08/12/64/162081264.db2.gz AXBHVKDFBWOWQC-DOMBMUJNSA-N 2 0 289.379 2.680 20 5 CFBDRP C[NH+](C)C1CCC([NH2+]Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000353391780 276754711 /nfs/dbraw/zinc/75/47/11/276754711.db2.gz DMBZPTASEMYJMK-UHFFFAOYSA-N 2 0 277.368 2.557 20 5 CFBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000423348123 278298610 /nfs/dbraw/zinc/29/86/10/278298610.db2.gz SQCKOKIKPICNOT-BBRMVZONSA-N 2 0 291.395 2.505 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@@H](C)C[C@@H](C)[NH3+])cc1[N+](=O)[O-] ZINC000422918359 280978803 /nfs/dbraw/zinc/97/88/03/280978803.db2.gz HDMGAEPAOULAQY-WOPDTQHZSA-N 2 0 265.357 2.680 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H]([C@@H](C)[NH3+])C1 ZINC000420300907 281022025 /nfs/dbraw/zinc/02/20/25/281022025.db2.gz DHXDICPFPQJHDQ-FRRDWIJNSA-N 2 0 277.368 2.633 20 5 CFBDRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000332298316 295313748 /nfs/dbraw/zinc/31/37/48/295313748.db2.gz MRCZVQULAYPHIM-WWGRRREGSA-N 2 0 289.379 2.832 20 5 CFBDRP CC(C)c1ccc(C[NH2+][C@H](C)C[C@@H](C)[NH3+])cc1[N+](=O)[O-] ZINC000575180805 322720954 /nfs/dbraw/zinc/72/09/54/322720954.db2.gz DDVKAOKKFOVHLZ-VXGBXAGGSA-N 2 0 279.384 2.934 20 5 CFBDRP C[C@@H](C[NH3+])C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000414871577 533769467 /nfs/dbraw/zinc/76/94/67/533769467.db2.gz DHBYTEYBGNVLMA-NSHDSACASA-N 2 0 289.335 2.539 20 5 CFBDRP C[C@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])[C@H]1CCC[NH2+]C1 ZINC000414855016 533789144 /nfs/dbraw/zinc/78/91/44/533789144.db2.gz MRAXQHZIJQBUMZ-HSRYQADGSA-N 2 0 289.379 2.586 20 5 CFBDRP C[C@H]([NH2+]C[C@@H]1CCC[C@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000423455969 533884304 /nfs/dbraw/zinc/88/43/04/533884304.db2.gz GHICSZPRPBHCBI-SCRDCRAPSA-N 2 0 277.368 2.763 20 5 CFBDRP Cc1c([C@@H](C)[NH2+]CC[C@@H]2CCC[NH2+]C2)cccc1[N+](=O)[O-] ZINC000423256904 533942868 /nfs/dbraw/zinc/94/28/68/533942868.db2.gz GONIVCIOOUNHBW-KGLIPLIRSA-N 2 0 291.395 2.944 20 5 CFBDRP C[C@H]([NH2+]CCCC[NH+](C)C)c1cccc([N+](=O)[O-])c1 ZINC000045663737 525334003 /nfs/dbraw/zinc/33/40/03/525334003.db2.gz ICNGILWYOCSDQI-LBPRGKRZSA-N 2 0 265.357 2.587 20 5 CFBDRP CCC[C@@H]([NH2+]C[C@H](C)C[NH3+])c1cccc([N+](=O)[O-])c1 ZINC000423297305 529011560 /nfs/dbraw/zinc/01/15/60/529011560.db2.gz JRRVWQHXMZUHIA-BXUZGUMPSA-N 2 0 265.357 2.620 20 5 CFBDRP CC1(C)C[C@@H]([NH3+])C[C@H]([NH2+]CCc2ccccc2[N+](=O)[O-])C1 ZINC000925517247 618855804 /nfs/dbraw/zinc/85/58/04/618855804.db2.gz ZSKKSNXBHUGJMF-KBPBESRZSA-N 2 0 291.395 2.633 20 5 CFBDRP CC[C@H]([NH2+][C@H]1C[C@@H]([NH3+])C12CCC2)c1cccc([N+](=O)[O-])c1 ZINC000925540488 618899597 /nfs/dbraw/zinc/89/95/97/618899597.db2.gz CKEMFCYNTDTHFP-ZNMIVQPWSA-N 2 0 289.379 2.905 20 5 CFBDRP CC(C)(C[NH3+])C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000903789335 621442358 /nfs/dbraw/zinc/44/23/58/621442358.db2.gz TWQHBYJXKXFSGY-UHFFFAOYSA-N 2 0 291.395 2.792 20 5 CFBDRP C[C@@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccc([N+](=O)[O-])cc1 ZINC000903987422 621499586 /nfs/dbraw/zinc/49/95/86/621499586.db2.gz GEAJOEAMRAVNIE-FAAHXZRKSA-N 2 0 289.379 2.634 20 5 CFBDRP C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C[NH3+])[C@H](C)C1 ZINC000923498728 626477100 /nfs/dbraw/zinc/47/71/00/626477100.db2.gz JJJLHNZVKZBMHE-DYEKYZERSA-N 2 0 277.368 2.573 20 5 CFBDRP CC1(C)C[C@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)c2cc([N+](=O)[O-])ccc21 ZINC000873258629 642103414 /nfs/dbraw/zinc/10/34/14/642103414.db2.gz SXLBRDZQNJUHBJ-PGUXBMHVSA-N 2 0 289.379 2.644 20 5 CFBDRP C[NH+]1CCC(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000084440107 650774217 /nfs/dbraw/zinc/77/42/17/650774217.db2.gz MRSDTJSGQJOUKL-UHFFFAOYSA-N 2 0 297.786 2.680 20 5 CFBDRP C[C@@H]([C@H](OCC[N+](C)(C)C)c1ccccc1)[NH+]1CCCC1 ZINC001224771163 775270310 /nfs/dbraw/zinc/27/03/10/775270310.db2.gz HQHBNILNCHROOM-WMZOPIPTSA-N 2 0 291.459 2.935 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)cc1[N+](=O)[O-] ZINC000594509020 349435241 /nfs/dbraw/zinc/43/52/41/349435241.db2.gz GSBFAOIRLLHNMU-KCQAQPDRSA-N 2 0 291.395 2.894 20 5 CFBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC[NH2+]C ZINC000423205942 529418403 /nfs/dbraw/zinc/41/84/03/529418403.db2.gz WHQYXVBXYIQVDD-GFCCVEGCSA-N 2 0 297.424 2.665 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+]CCC2(C[NH3+])CC2)cc1[N+](=O)[O-] ZINC000593318220 349246632 /nfs/dbraw/zinc/24/66/32/349246632.db2.gz BOGTVGXEJWBMQH-LBPRGKRZSA-N 2 0 277.368 2.683 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](C)[C@@H]1CC[NH3+] ZINC000593316195 349246823 /nfs/dbraw/zinc/24/68/23/349246823.db2.gz NAZWLHFJPQLPKE-LRDDRELGSA-N 2 0 291.395 2.853 20 5 CFBDRP Cc1ccc(C[N@H+]2CCC[C@H](C)[C@@H]2CC[NH3+])cc1[N+](=O)[O-] ZINC000593317800 349246858 /nfs/dbraw/zinc/24/68/58/349246858.db2.gz YOYINBVHOVRYFV-WFASDCNBSA-N 2 0 291.395 2.853 20 5 CFBDRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000414806553 233359779 /nfs/dbraw/zinc/35/97/79/233359779.db2.gz HRBCJDORTVBVOX-GFCCVEGCSA-N 2 0 285.347 2.904 20 5 CFBDRP C[N@@H+]1CCCC[C@@H](CNCc2ccc([N+](=O)[O-])cc2F)C1 ZINC000598995258 350356171 /nfs/dbraw/zinc/35/61/71/350356171.db2.gz WXJCJQBAYOPOKP-LBPRGKRZSA-N 2 0 295.358 2.555 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1CNC[C@@H]1CCCC[N@@H+](C)C1 ZINC000598994387 350356595 /nfs/dbraw/zinc/35/65/95/350356595.db2.gz MAJDTRZZCKMZFT-AWEZNQCLSA-N 2 0 291.395 2.725 20 5 CFBDRP Cc1c([C@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)cccc1[N+](=O)[O-] ZINC000423245767 238304776 /nfs/dbraw/zinc/30/47/76/238304776.db2.gz JJMYUPJGBPKABK-QWHCGFSZSA-N 2 0 277.368 2.553 20 5 CFBDRP CC[NH2+]CC1CC[NH+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000129864284 377483464 /nfs/dbraw/zinc/48/34/64/377483464.db2.gz LDAQZVFGDDTVMZ-CYBMUJFWSA-N 2 0 291.395 2.977 20 5 CFBDRP Cc1c(C[NH2+][C@H](C)CCCC[NH3+])cccc1[N+](=O)[O-] ZINC000336818399 380682687 /nfs/dbraw/zinc/68/26/87/380682687.db2.gz VKEYGSCHHJVACU-LLVKDONJSA-N 2 0 265.357 2.510 20 5 CFBDRP CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)CCCC[NH3+] ZINC000415008235 381703186 /nfs/dbraw/zinc/70/31/86/381703186.db2.gz DAQAXDJEJNJDJZ-GFCCVEGCSA-N 2 0 295.383 2.601 20 5 CFBDRP CC(C)[C@@H]([NH3+])CC[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000346693378 382478009 /nfs/dbraw/zinc/47/80/09/382478009.db2.gz MRZAASLRAXXNNB-LYASGUKUSA-N 2 0 291.395 2.913 20 5 CFBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000226326101 382826795 /nfs/dbraw/zinc/82/67/95/382826795.db2.gz OJFWLZPPMOBLJS-OLZOCXBDSA-N 2 0 277.368 2.717 20 5 CFBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000226326096 382826829 /nfs/dbraw/zinc/82/68/29/382826829.db2.gz OJFWLZPPMOBLJS-STQMWFEESA-N 2 0 277.368 2.717 20 5 CFBDRP Cc1c([C@@H](C)[NH2+]CC2CC[NH2+]CC2)cccc1[N+](=O)[O-] ZINC000576861467 382838917 /nfs/dbraw/zinc/83/89/17/382838917.db2.gz UEGJSPKTJBBKAN-GFCCVEGCSA-N 2 0 277.368 2.553 20 5 CFBDRP [NH3+][C@H]1CCC[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000577650212 382866692 /nfs/dbraw/zinc/86/66/92/382866692.db2.gz IDSFFUZRYOPVBU-STQMWFEESA-N 2 0 297.786 2.650 20 5 CFBDRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000423037373 383024007 /nfs/dbraw/zinc/02/40/07/383024007.db2.gz BHDDTCKLOMAJKR-WCQYABFASA-N 2 0 297.786 2.508 20 5 CFBDRP C[C@@H]1CC2(C[N@@H+]1Cc1ccccc1[N+](=O)[O-])CC[NH2+]CC2 ZINC000572713241 383808756 /nfs/dbraw/zinc/80/87/56/383808756.db2.gz YGVSBACFHABEBQ-CYBMUJFWSA-N 2 0 289.379 2.559 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453592888 383863697 /nfs/dbraw/zinc/86/36/97/383863697.db2.gz FUSVXQUNYZYHFL-UHFFFAOYSA-N 2 0 291.395 2.867 20 5 CFBDRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000532474889 384033529 /nfs/dbraw/zinc/03/35/29/384033529.db2.gz WIFGKLLJUUZTRC-ZIAGYGMSSA-N 2 0 291.395 2.896 20 5 CFBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(C[NH+](C)C)CC1 ZINC000350917126 163112482 /nfs/dbraw/zinc/11/24/82/163112482.db2.gz HXWXTEPVDMJAAI-CYBMUJFWSA-N 2 0 291.395 2.929 20 5 CFBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000414827331 533682369 /nfs/dbraw/zinc/68/23/69/533682369.db2.gz KJFPKPAAMDNOEN-UONOGXRCSA-N 2 0 291.395 2.505 20 5 CFBDRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000044516227 279464279 /nfs/dbraw/zinc/46/42/79/279464279.db2.gz HIXAAWRJFHOHOX-LBPRGKRZSA-N 2 0 277.368 2.587 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H](C)[C@@H](C[NH3+])C1 ZINC000420406848 281021892 /nfs/dbraw/zinc/02/18/92/281021892.db2.gz OCHNFXOINFPZES-UBHSHLNASA-N 2 0 291.395 2.881 20 5 CFBDRP CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[NH2+]CC1 ZINC000435392541 281234961 /nfs/dbraw/zinc/23/49/61/281234961.db2.gz WZTZYSOKQKOWLS-CQSZACIVSA-N 2 0 277.368 2.559 20 5 CFBDRP CC[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CCC[NH2+]CC1 ZINC000435393398 281235055 /nfs/dbraw/zinc/23/50/55/281235055.db2.gz ZKTHGMYJPSFJGM-AWEZNQCLSA-N 2 0 277.368 2.559 20 5 CFBDRP Cc1c([C@@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)cccc1[N+](=O)[O-] ZINC000423245765 533943511 /nfs/dbraw/zinc/94/35/11/533943511.db2.gz JJMYUPJGBPKABK-CHWSQXEVSA-N 2 0 277.368 2.553 20 5 CFBDRP C[C@H](C[NH3+])C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000414869761 534048848 /nfs/dbraw/zinc/04/88/48/534048848.db2.gz BFODNPRSUFQWIV-LLVKDONJSA-N 2 0 289.335 2.539 20 5 CFBDRP CC(C)c1ccc(C[NH2+]C[C@@H]2CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000414841938 528100497 /nfs/dbraw/zinc/10/04/97/528100497.db2.gz ZSLQVSOFFYDIOB-CQSZACIVSA-N 2 0 291.395 2.807 20 5 CFBDRP CCC[C@@H]([NH2+]C[C@@H](C)C[NH2+]C)c1cccc([N+](=O)[O-])c1 ZINC000423255486 529010117 /nfs/dbraw/zinc/01/01/17/529010117.db2.gz AFUBCZGRNWKQKR-SWLSCSKDSA-N 2 0 279.384 2.881 20 5 CFBDRP CC1(C)C[C@@H]([NH3+])C[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C1 ZINC000925592933 618280158 /nfs/dbraw/zinc/28/01/58/618280158.db2.gz IAKDWOSQNZVPGC-STQMWFEESA-N 2 0 277.368 2.590 20 5 CFBDRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000925880892 619201526 /nfs/dbraw/zinc/20/15/26/619201526.db2.gz WMFCDOXYRJXCAS-GHJWDPDVSA-N 2 0 289.379 2.689 20 5 CFBDRP Cc1c(C[NH2+][C@H]2CC[NH2+]CC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000902375003 621046535 /nfs/dbraw/zinc/04/65/35/621046535.db2.gz FRNDOMLCWNQVAA-AWEZNQCLSA-N 2 0 291.395 2.771 20 5 CFBDRP CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000903432423 621372476 /nfs/dbraw/zinc/37/24/76/621372476.db2.gz BGLMTPHIBCHMPI-CABCVRRESA-N 2 0 291.395 2.933 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+]C[C@H]2CCCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000903757904 621438587 /nfs/dbraw/zinc/43/85/87/621438587.db2.gz IMYAXQAAURUINM-KBPBESRZSA-N 2 0 291.395 2.944 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000903757905 621438755 /nfs/dbraw/zinc/43/87/55/621438755.db2.gz IMYAXQAAURUINM-KGLIPLIRSA-N 2 0 291.395 2.944 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC(C)(C)[NH3+] ZINC000903939270 621474517 /nfs/dbraw/zinc/47/45/17/621474517.db2.gz FCSQBGAKHUYPNL-GFCCVEGCSA-N 2 0 279.384 2.633 20 5 CFBDRP CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904312869 621571135 /nfs/dbraw/zinc/57/11/35/621571135.db2.gz OVWYRPYMKAZCPL-OKILXGFUSA-N 2 0 277.368 2.543 20 5 CFBDRP C[C@@H]1C[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CC[C@H]1C[NH3+] ZINC000923499740 626477415 /nfs/dbraw/zinc/47/74/15/626477415.db2.gz SXNIDBYBPLCHAZ-MNOVXSKESA-N 2 0 297.786 2.665 20 5 CFBDRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000841078871 631333451 /nfs/dbraw/zinc/33/34/51/631333451.db2.gz HTVKEMVYSMNTHT-SNVBAGLBSA-N 2 0 285.775 2.855 20 5 CFBDRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872083043 641616712 /nfs/dbraw/zinc/61/67/12/641616712.db2.gz GICMQNHCEYHHQS-UTUOFQBUSA-N 2 0 295.358 2.725 20 5 CFBDRP Cc1c(CN[C@@H]2CCC[C@H]([NH+](C)C)C2)cccc1[N+](=O)[O-] ZINC000873069557 642002786 /nfs/dbraw/zinc/00/27/86/642002786.db2.gz JYYLJZBRNCRHDF-CABCVRRESA-N 2 0 291.395 2.866 20 5 CFBDRP C[NH+](C)[C@H]1CCC[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000877073215 643135724 /nfs/dbraw/zinc/13/57/24/643135724.db2.gz FNXCLVYHILKGAC-HOCLYGCPSA-N 2 0 291.395 2.600 20 5 CFBDRP C[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C1CCC([NH3+])CC1 ZINC000091846420 650909892 /nfs/dbraw/zinc/90/98/92/650909892.db2.gz VQCMQTXIXCYAIW-UHFFFAOYSA-N 2 0 297.786 2.950 20 5 CFBDRP C[C@H]([NH2+][C@H]1CCCC[C@H]1C[NH3+])c1cccc([N+](=O)[O-])c1 ZINC000251542437 650989633 /nfs/dbraw/zinc/98/96/33/650989633.db2.gz OYSSTFBOPKMFTB-WHOFXGATSA-N 2 0 277.368 2.763 20 5 CFBDRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1C[NH3+])c1cccc([N+](=O)[O-])c1 ZINC000251542425 650989684 /nfs/dbraw/zinc/98/96/84/650989684.db2.gz OYSSTFBOPKMFTB-CORIIIEPSA-N 2 0 277.368 2.763 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+]CCC(C)(C)[NH3+])cc1[N+](=O)[O-] ZINC000925739873 648305837 /nfs/dbraw/zinc/30/58/37/648305837.db2.gz ANNLUCONMOLFMG-NSHDSACASA-N 2 0 265.357 2.681 20 5 CFBDRP C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1CC[NH3+] ZINC000723891015 770707080 /nfs/dbraw/zinc/70/70/80/770707080.db2.gz JWPSZSHWIAYABC-GHMZBOCLSA-N 2 0 297.786 2.665 20 5 CFBDRP C[C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1OCC[N+](C)(C)C ZINC001224772038 775269435 /nfs/dbraw/zinc/26/94/35/775269435.db2.gz WIAAUBQJHYNSRQ-WMZOPIPTSA-N 2 0 291.459 2.620 20 5 CFBDRP C[N+](C)(C)CCO[C@@H]1CC[N@H+](Cc2ccc(Cl)cc2)C1 ZINC001224775949 778681400 /nfs/dbraw/zinc/68/14/00/778681400.db2.gz QDGQXKDCAXXCLQ-MRXNPFEDSA-N 2 0 297.850 2.637 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C)cc1[N+](=O)[O-] ZINC000596655344 349969920 /nfs/dbraw/zinc/96/99/20/349969920.db2.gz VMVNCFQPCHVSOA-TZMCWYRMSA-N 2 0 279.384 2.927 20 5 CFBDRP C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1 ZINC000402902580 348583154 /nfs/dbraw/zinc/58/31/54/348583154.db2.gz QZVBMXXDOGDIBR-NOLJZWGESA-N 2 0 289.379 2.717 20 5 CFBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1 ZINC000402896413 348583253 /nfs/dbraw/zinc/58/32/53/348583253.db2.gz OIOADQLJIZPPLF-XEZPLFJOSA-N 2 0 289.379 2.717 20 5 CFBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000591278454 349006449 /nfs/dbraw/zinc/00/64/49/349006449.db2.gz DLXZKNKBVZPGON-DZGCQCFKSA-N 2 0 291.395 2.648 20 5 CFBDRP C[N@H+](CCCC1CC[NH2+]CC1)Cc1ccccc1[N+](=O)[O-] ZINC000592476544 349127013 /nfs/dbraw/zinc/12/70/13/349127013.db2.gz IAYKOYRPFRFZRZ-UHFFFAOYSA-N 2 0 291.395 2.806 20 5 CFBDRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000414793848 233353215 /nfs/dbraw/zinc/35/32/15/233353215.db2.gz FDXKEALAZSWEQP-YKHJJTLOSA-N 2 0 289.379 2.715 20 5 CFBDRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000414793846 233353293 /nfs/dbraw/zinc/35/32/93/233353293.db2.gz FDXKEALAZSWEQP-PYMSSDGJSA-N 2 0 289.379 2.715 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000414794470 233353762 /nfs/dbraw/zinc/35/37/62/233353762.db2.gz FRZQUANUPMYPGE-DOMZBBRYSA-N 2 0 277.368 2.510 20 5 CFBDRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000222967126 540152033 /nfs/dbraw/zinc/15/20/33/540152033.db2.gz HWODEEVOLQUFFW-CYZMBNFOSA-N 2 0 263.341 2.515 20 5 CFBDRP O=[N+]([O-])c1cc(C[NH2+]CC2CC[NH+](C3CC3)CC2)cs1 ZINC000278484557 194005342 /nfs/dbraw/zinc/00/53/42/194005342.db2.gz JZWXONDCPWFFGD-UHFFFAOYSA-N 2 0 295.408 2.620 20 5 CFBDRP C[C@@H]([NH3+])C1CC[NH+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000347183471 380989691 /nfs/dbraw/zinc/98/96/91/380989691.db2.gz XHBXSHCNBBNIBW-RYWCDNDXSA-N 2 0 289.379 2.667 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@H](C[NH3+])C[C@H]1C ZINC000420319802 382366960 /nfs/dbraw/zinc/36/69/60/382366960.db2.gz POASBYLIXRTGCZ-AGIUHOORSA-N 2 0 277.368 2.633 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000420418631 382403073 /nfs/dbraw/zinc/40/30/73/382403073.db2.gz XBWQOSKNUFIEHT-OLZOCXBDSA-N 2 0 277.368 2.553 20 5 CFBDRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000387212356 382596988 /nfs/dbraw/zinc/59/69/88/382596988.db2.gz JVFZWRAEEGUDBH-UHFFFAOYSA-N 2 0 297.374 2.944 20 5 CFBDRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000423047051 383028297 /nfs/dbraw/zinc/02/82/97/383028297.db2.gz UOHXDLLIKHKGOZ-ZJUUUORDSA-N 2 0 285.775 2.506 20 5 CFBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](C)C[NH+](C)C ZINC000491558900 533408370 /nfs/dbraw/zinc/40/83/70/533408370.db2.gz HSBBDGKYMSNCCO-CZAWJFPGSA-N 2 0 291.395 2.785 20 5 CFBDRP C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)[C@H]1CCC[NH2+]C1 ZINC000422949628 533506448 /nfs/dbraw/zinc/50/64/48/533506448.db2.gz UPZRVUZDZAPPMU-SCRDCRAPSA-N 2 0 277.368 2.634 20 5 CFBDRP CCCN(CCC[NH+](C)C)Cc1ccc([N+](=O)[O-])cc1F ZINC000349368795 393968991 /nfs/dbraw/zinc/96/89/91/393968991.db2.gz ONMNQWKUDULWGW-UHFFFAOYSA-N 2 0 297.374 2.898 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC(C[NH3+])CC1 ZINC000420281252 394114916 /nfs/dbraw/zinc/11/49/16/394114916.db2.gz ZZQDSQOMKHBDAS-GFCCVEGCSA-N 2 0 277.368 2.635 20 5 CFBDRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000422915026 394258425 /nfs/dbraw/zinc/25/84/25/394258425.db2.gz AKXMFHOWFWTCFG-GOEBONIOSA-N 2 0 291.395 2.635 20 5 CFBDRP C[C@@H]1C[C@H]([NH2+]C/C=C/c2ccccc2[N+](=O)[O-])CC[N@@H+]1C ZINC000344610623 162079748 /nfs/dbraw/zinc/07/97/48/162079748.db2.gz AXBHVKDFBWOWQC-RLWBPUTGSA-N 2 0 289.379 2.680 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+]CC2CC[NH+](C)CC2)cc1[N+](=O)[O-] ZINC000044516000 175189997 /nfs/dbraw/zinc/18/99/97/175189997.db2.gz USDXBIRVFGEMCT-ZDUSSCGKSA-N 2 0 291.395 2.896 20 5 CFBDRP CC[C@H]([NH3+])C[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000414994736 280882713 /nfs/dbraw/zinc/88/27/13/280882713.db2.gz VESOBVAONWEIOB-AEGPPILISA-N 2 0 291.395 2.633 20 5 CFBDRP CC(C)c1ccc(C[NH2+][C@@H](C)C[C@@H](C)[NH3+])cc1[N+](=O)[O-] ZINC000575180802 322720952 /nfs/dbraw/zinc/72/09/52/322720952.db2.gz DDVKAOKKFOVHLZ-NEPJUHHUSA-N 2 0 279.384 2.934 20 5 CFBDRP [NH3+]CC[C@H]1CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000442920076 534654518 /nfs/dbraw/zinc/65/45/18/534654518.db2.gz GJPDKECVIVANKO-BTKRWWFXSA-N 2 0 289.379 2.669 20 5 CFBDRP CCC[C@H]([NH2+]C[C@H](C)C[NH3+])c1cccc([N+](=O)[O-])c1 ZINC000423297307 528224441 /nfs/dbraw/zinc/22/44/41/528224441.db2.gz JRRVWQHXMZUHIA-RISCZKNCSA-N 2 0 265.357 2.620 20 5 CFBDRP CCC([NH3+])(CC)C[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000423291124 528952572 /nfs/dbraw/zinc/95/25/72/528952572.db2.gz GWZZQXVHKOSKFL-GFCCVEGCSA-N 2 0 279.384 2.633 20 5 CFBDRP [NH3+]CCCCCCC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000903883753 621463798 /nfs/dbraw/zinc/46/37/98/621463798.db2.gz YZRPBZWGSZXVKF-UHFFFAOYSA-N 2 0 291.395 2.862 20 5 CFBDRP Cc1c([C@@H](C)[NH2+][C@H](C)C2CC[NH2+]CC2)cccc1[N+](=O)[O-] ZINC000873268600 642110920 /nfs/dbraw/zinc/11/09/20/642110920.db2.gz XXALLCINJNTRAX-CHWSQXEVSA-N 2 0 291.395 2.942 20 5 CFBDRP C[NH+](C)[C@H]1CCC[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000877073216 643135578 /nfs/dbraw/zinc/13/55/78/643135578.db2.gz FNXCLVYHILKGAC-ZBFHGGJFSA-N 2 0 291.395 2.600 20 5 CFBDRP C[C@H]([NH2+][C@H]1C[C@@H]([NH3+])C12CCC2)c1ccc([N+](=O)[O-])cc1 ZINC000925675229 648274381 /nfs/dbraw/zinc/27/43/81/648274381.db2.gz MKNFFIOTRSWFKC-GDLCADMTSA-N 2 0 275.352 2.515 20 5 CFBDRP C[C@H](C[N+](C)(C)C)O[C@H](CC[NH+](C)C)c1ccccc1 ZINC001224133274 775107574 /nfs/dbraw/zinc/10/75/74/775107574.db2.gz KNYXFJAFUPYSDL-NVXWUHKLSA-N 2 0 279.448 2.791 20 5 CFBDRP C[C@@H](C[N+](C)(C)C)Oc1cccc([C@H](C)[NH+](C)C)c1 ZINC001229620780 776857525 /nfs/dbraw/zinc/85/75/25/776857525.db2.gz DLNJSVPWQSCCLP-KBPBESRZSA-N 2 0 265.421 2.783 20 5 CFBDRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000594509014 349434771 /nfs/dbraw/zinc/43/47/71/349434771.db2.gz GRAMGSHPISJNGL-TYNCELHUSA-N 2 0 289.379 2.512 20 5 CFBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](C)C[NH3+] ZINC000423311192 529418275 /nfs/dbraw/zinc/41/82/75/529418275.db2.gz SVTQZWLBAOHAAE-NWDGAFQWSA-N 2 0 297.424 2.650 20 5 CFBDRP C[N@@H+]1CC[C@]2(C1)CCCN(Cc1ccc([N+](=O)[O-])cc1)C2 ZINC000595508422 349645832 /nfs/dbraw/zinc/64/58/32/349645832.db2.gz XMRTVXNQUKGHEX-INIZCTEOSA-N 2 0 289.379 2.513 20 5 CFBDRP CC(C)[C@H]([NH3+])CC[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000596111679 349797055 /nfs/dbraw/zinc/79/70/55/349797055.db2.gz ZZQOFZGYLYCYGH-UKRRQHHQSA-N 2 0 293.411 2.879 20 5 CFBDRP C[NH2+]CCC[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000414863062 529971343 /nfs/dbraw/zinc/97/13/43/529971343.db2.gz WRRXCPKJQMLDGR-DZGCQCFKSA-N 2 0 291.395 2.505 20 5 CFBDRP Cc1c(C[NH2+][C@H](C)C2CC[NH+](C)CC2)cccc1[N+](=O)[O-] ZINC000231883782 348209838 /nfs/dbraw/zinc/20/98/38/348209838.db2.gz KIZSLQCDVYFEQS-CYBMUJFWSA-N 2 0 291.395 2.723 20 5 CFBDRP C[C@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H]1CC[NH3+] ZINC000404411539 348591025 /nfs/dbraw/zinc/59/10/25/348591025.db2.gz XWRFMUQMCUNIAL-BBRMVZONSA-N 2 0 291.395 2.587 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC[NH2+]CC1 ZINC000591278455 349006464 /nfs/dbraw/zinc/00/64/64/349006464.db2.gz DLXZKNKBVZPGON-HIFRSBDPSA-N 2 0 291.395 2.648 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](C)[C@H]1CC[NH3+] ZINC000593316197 349246407 /nfs/dbraw/zinc/24/64/07/349246407.db2.gz NAZWLHFJPQLPKE-MLGOLLRUSA-N 2 0 291.395 2.853 20 5 CFBDRP C[C@@H]1C[C@H](C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)CC[NH2+]1 ZINC000414712747 233335450 /nfs/dbraw/zinc/33/54/50/233335450.db2.gz OGVQHBQIHYPKSV-CHWSQXEVSA-N 2 0 291.395 2.808 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000414826866 233368027 /nfs/dbraw/zinc/36/80/27/233368027.db2.gz GISKACJVPDGZHT-ZIAGYGMSSA-N 2 0 291.395 2.505 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1CNC[C@H]1CCCC[N@@H+](C)C1 ZINC000598994388 350356864 /nfs/dbraw/zinc/35/68/64/350356864.db2.gz MAJDTRZZCKMZFT-CQSZACIVSA-N 2 0 291.395 2.725 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000415039362 233443714 /nfs/dbraw/zinc/44/37/14/233443714.db2.gz NYEYGIPEAXAIMD-IPYPFGDCSA-N 2 0 291.395 2.633 20 5 CFBDRP CC[C@H]([NH2+]CC1CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000297458031 200198180 /nfs/dbraw/zinc/19/81/80/200198180.db2.gz QRGOXNCHKORIFO-HNNXBMFYSA-N 2 0 277.368 2.635 20 5 CFBDRP CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[NH2+]CC1 ZINC000435630133 240335081 /nfs/dbraw/zinc/33/50/81/240335081.db2.gz ZSJRVRHJLZLFPT-OAHLLOKOSA-N 2 0 291.395 2.601 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000571444416 383694554 /nfs/dbraw/zinc/69/45/54/383694554.db2.gz AYPCABUKHZWFHP-UHFFFAOYSA-N 2 0 285.347 2.652 20 5 CFBDRP O=[N+]([O-])c1cccc(C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)c1 ZINC000063197923 373794854 /nfs/dbraw/zinc/79/48/54/373794854.db2.gz CUWRROLBQDLSSN-INIZCTEOSA-N 2 0 289.379 2.559 20 5 CFBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](C)C[NH+](C)C ZINC000491558903 246080282 /nfs/dbraw/zinc/08/02/82/246080282.db2.gz HSBBDGKYMSNCCO-YLHGKKIISA-N 2 0 291.395 2.785 20 5 CFBDRP Cc1c(C[NH+]2CCC(C[NH+](C)C)CC2)cccc1[N+](=O)[O-] ZINC000341174073 380815488 /nfs/dbraw/zinc/81/54/88/380815488.db2.gz FJAAWPRZOOSGRB-UHFFFAOYSA-N 2 0 291.395 2.677 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000414933558 381623824 /nfs/dbraw/zinc/62/38/24/381623824.db2.gz XAJPAJSCSNBKCV-SNPRPXQTSA-N 2 0 291.395 2.775 20 5 CFBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000414954934 381647086 /nfs/dbraw/zinc/64/70/86/381647086.db2.gz SYIGFRJMAAOXCK-GZBFAFLISA-N 2 0 291.395 2.646 20 5 CFBDRP CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)CCCC[NH3+] ZINC000415008236 381701873 /nfs/dbraw/zinc/70/18/73/381701873.db2.gz DAQAXDJEJNJDJZ-LBPRGKRZSA-N 2 0 295.383 2.601 20 5 CFBDRP O=[N+]([O-])c1ccc(C[N@H+](CC[C@@H]2CC[NH2+]C2)C2CC2)cc1 ZINC000420358508 382382358 /nfs/dbraw/zinc/38/23/58/382382358.db2.gz JGTUUWWWOIUMFY-ZDUSSCGKSA-N 2 0 289.379 2.559 20 5 CFBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000386367743 382588460 /nfs/dbraw/zinc/58/84/60/382588460.db2.gz OQJLEAYCSWPSBB-MELADBBJSA-N 2 0 289.379 2.587 20 5 CFBDRP Cc1c(C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])cccc1[N+](=O)[O-] ZINC000231883875 382867405 /nfs/dbraw/zinc/86/74/05/382867405.db2.gz JDMYSPCJPWCFGL-GXTWGEPZSA-N 2 0 277.368 2.510 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H]([NH3+])C2)cc1[N+](=O)[O-] ZINC000423393628 383079353 /nfs/dbraw/zinc/07/93/53/383079353.db2.gz QSZOVAOVPZXWLA-FPMFFAJLSA-N 2 0 277.368 2.824 20 5 CFBDRP CC[C@H]([NH2+]CC[C@H]1CCC[NH2+]1)c1cccc([N+](=O)[O-])c1 ZINC000423369103 383067834 /nfs/dbraw/zinc/06/78/34/383067834.db2.gz SIZZCHLKOCXBFM-HIFRSBDPSA-N 2 0 277.368 2.778 20 5 CFBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)[C@H](C)[NH3+] ZINC000423446073 383098917 /nfs/dbraw/zinc/09/89/17/383098917.db2.gz NQLLKSJJIQHDSP-SDDRHHMPSA-N 2 0 297.424 2.791 20 5 CFBDRP CC[NH2+]CC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000261617321 383529978 /nfs/dbraw/zinc/52/99/78/383529978.db2.gz FZJLXPFRAGITPQ-UHFFFAOYSA-N 2 0 295.358 2.555 20 5 CFBDRP C[NH+]1CCC(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])CC1 ZINC000570941949 383649886 /nfs/dbraw/zinc/64/98/86/383649886.db2.gz SGGZMIXBGOTJGO-HNNXBMFYSA-N 2 0 289.379 2.514 20 5 CFBDRP C[C@@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1 ZINC000423265216 533403340 /nfs/dbraw/zinc/40/33/40/533403340.db2.gz ZRNXQRKASABJGF-CHWSQXEVSA-N 2 0 277.368 2.635 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H](C)[C@@H](C[NH3+])C1 ZINC000420406849 292296303 /nfs/dbraw/zinc/29/63/03/292296303.db2.gz OCHNFXOINFPZES-XBFCOCLRSA-N 2 0 291.395 2.881 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000414933554 279275108 /nfs/dbraw/zinc/27/51/08/279275108.db2.gz XAJPAJSCSNBKCV-BPLDGKMQSA-N 2 0 291.395 2.775 20 5 CFBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000423348125 279381918 /nfs/dbraw/zinc/38/19/18/279381918.db2.gz SQCKOKIKPICNOT-CZUORRHYSA-N 2 0 291.395 2.505 20 5 CFBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000423278197 279382045 /nfs/dbraw/zinc/38/20/45/279382045.db2.gz QTEUHHUURXDISM-ZIAGYGMSSA-N 2 0 291.395 2.505 20 5 CFBDRP C[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])[C@@H]1CCC[NH2+]C1 ZINC000414855015 533788753 /nfs/dbraw/zinc/78/87/53/533788753.db2.gz MRAXQHZIJQBUMZ-HIINFBLBSA-N 2 0 289.379 2.586 20 5 CFBDRP Cc1c([C@@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)cccc1[N+](=O)[O-] ZINC000423245766 533944280 /nfs/dbraw/zinc/94/42/80/533944280.db2.gz JJMYUPJGBPKABK-OLZOCXBDSA-N 2 0 277.368 2.553 20 5 CFBDRP Cc1c([C@H](C)[NH2+][C@H](C)CCC[NH3+])cccc1[N+](=O)[O-] ZINC000423454557 533955115 /nfs/dbraw/zinc/95/51/15/533955115.db2.gz LRRNUGBUPVYDPS-PWSUYJOCSA-N 2 0 265.357 2.681 20 5 CFBDRP [NH3+]CC[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000093633677 619041573 /nfs/dbraw/zinc/04/15/73/619041573.db2.gz NXDUCHVQNYJEGX-LLVKDONJSA-N 2 0 297.786 2.809 20 5 CFBDRP C[C@H]([NH3+])C1CC[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000093633655 619041615 /nfs/dbraw/zinc/04/16/15/619041615.db2.gz VSJQMLDVIIESAI-JTQLQIEISA-N 2 0 297.786 2.807 20 5 CFBDRP C[NH2+]CC1CC[NH+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000261949685 619345809 /nfs/dbraw/zinc/34/58/09/619345809.db2.gz NRXJHVNKUBPAKR-UHFFFAOYSA-N 2 0 297.786 2.680 20 5 CFBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1([NH3+])CC1 ZINC000902413937 621084243 /nfs/dbraw/zinc/08/42/43/621084243.db2.gz PYRWNVSNPPMLBN-NSHDSACASA-N 2 0 295.408 2.546 20 5 CFBDRP [NH3+][C@@H]1CC[C@H](C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000903455540 621388280 /nfs/dbraw/zinc/38/82/80/621388280.db2.gz ZICPDUYGFVXWSU-GXTWGEPZSA-N 2 0 289.379 2.687 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000903757907 621438509 /nfs/dbraw/zinc/43/85/09/621438509.db2.gz IMYAXQAAURUINM-ZIAGYGMSSA-N 2 0 291.395 2.944 20 5 CFBDRP C[C@@H]1C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])CC[C@H]1C[NH3+] ZINC000904410707 621591554 /nfs/dbraw/zinc/59/15/54/621591554.db2.gz FTONZDSFZHNKIM-CWNOIDMWSA-N 2 0 289.379 2.525 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H](C[NH3+])[C@H](C)C1 ZINC000923494808 626476849 /nfs/dbraw/zinc/47/68/49/626476849.db2.gz OVTFLFZYAWQPHT-RDBSUJKOSA-N 2 0 291.395 2.881 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H](C[NH3+])[C@@H](C)C1 ZINC000923494806 626476939 /nfs/dbraw/zinc/47/69/39/626476939.db2.gz OVTFLFZYAWQPHT-IHRRRGAJSA-N 2 0 291.395 2.881 20 5 CFBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C[NH3+])[C@H](C)C1 ZINC000923498725 626477132 /nfs/dbraw/zinc/47/71/32/626477132.db2.gz JJJLHNZVKZBMHE-BZPMIXESSA-N 2 0 277.368 2.573 20 5 CFBDRP C[C@H]([NH3+])C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000843052961 631818051 /nfs/dbraw/zinc/81/80/51/631818051.db2.gz QOEOPSNHUZHVFB-JTQLQIEISA-N 2 0 297.786 2.807 20 5 CFBDRP C[N@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)C1CCC([NH3+])CC1 ZINC000843054737 631818824 /nfs/dbraw/zinc/81/88/24/631818824.db2.gz DVFPHXCXTRGXMY-UHFFFAOYSA-N 2 0 297.786 2.950 20 5 CFBDRP Cc1ccc([N+](=O)[O-])c(C)c1CN[C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000873060297 641998227 /nfs/dbraw/zinc/99/82/27/641998227.db2.gz HOXQDKBHVXQYRA-TZMCWYRMSA-N 2 0 291.395 2.784 20 5 CFBDRP Cc1c([C@H](C)[NH2+][C@H](C)C2CC[NH2+]CC2)cccc1[N+](=O)[O-] ZINC000873268601 642111136 /nfs/dbraw/zinc/11/11/36/642111136.db2.gz XXALLCINJNTRAX-OLZOCXBDSA-N 2 0 291.395 2.942 20 5 CFBDRP C[NH+](C)CC[C@H](OCCC[N+](C)(C)C)c1ccccc1 ZINC001224620826 775227651 /nfs/dbraw/zinc/22/76/51/775227651.db2.gz CHOYATLZQBEPDS-KRWDZBQOSA-N 2 0 279.448 2.792 20 5 CFBDRP C[N+](C)(C)CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC001224618152 778602180 /nfs/dbraw/zinc/60/21/80/778602180.db2.gz DBFQEKHMNWGKBV-UHFFFAOYSA-N 2 0 291.459 2.764 20 5 CFBDRP Cc1c([C@H](C)[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)cccc1[N+](=O)[O-] ZINC000594510878 349435725 /nfs/dbraw/zinc/43/57/25/349435725.db2.gz PIEMCQCDMFPVBQ-MELADBBJSA-N 2 0 291.395 2.894 20 5 CFBDRP CC[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000594510871 349435962 /nfs/dbraw/zinc/43/59/62/349435962.db2.gz PFTRAUUCRXZRAS-MAZHCROVSA-N 2 0 291.395 2.976 20 5 CFBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](C)C[NH3+] ZINC000423311191 529534267 /nfs/dbraw/zinc/53/42/67/529534267.db2.gz SVTQZWLBAOHAAE-NEPJUHHUSA-N 2 0 297.424 2.650 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@@H]2CC23CC[NH2+]CC3)cc1[N+](=O)[O-] ZINC000591579301 349031715 /nfs/dbraw/zinc/03/17/15/349031715.db2.gz HXDNNVMPJJVUOF-SWLSCSKDSA-N 2 0 289.379 2.696 20 5 CFBDRP CC[C@@H]([NH2+]CCC1(C[NH3+])CC1)c1cccc([N+](=O)[O-])c1 ZINC000593318907 349246853 /nfs/dbraw/zinc/24/68/53/349246853.db2.gz HJFHUHSQYNQKRB-CQSZACIVSA-N 2 0 277.368 2.765 20 5 CFBDRP C[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1ccc([N+](=O)[O-])cc1 ZINC000593323975 349247619 /nfs/dbraw/zinc/24/76/19/349247619.db2.gz UZPCIRYHHPVQGW-GFCCVEGCSA-N 2 0 277.368 2.635 20 5 CFBDRP O=[N+]([O-])c1ccccc1/C=C\C[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000414849360 233376719 /nfs/dbraw/zinc/37/67/19/233376719.db2.gz LSMPJBRAWFTOPK-ZBKLQPJUSA-N 2 0 289.379 2.587 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@H]1CC[C@H](C[NH3+])CC1 ZINC000415022827 233439591 /nfs/dbraw/zinc/43/95/91/233439591.db2.gz JUMRVGUXXGRCFD-HDJSIYSDSA-N 2 0 291.395 2.758 20 5 CFBDRP Cc1cc(NC[C@H](C)[NH+](C)C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000122198981 187020192 /nfs/dbraw/zinc/02/01/92/187020192.db2.gz ZIKRNMGEGBLUMW-NSHDSACASA-N 2 0 288.351 2.813 20 5 CFBDRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000271813947 191343382 /nfs/dbraw/zinc/34/33/82/191343382.db2.gz BESRREJSRJJEAY-GFCCVEGCSA-N 2 0 275.352 2.507 20 5 CFBDRP Cc1c([C@H](C)[NH2+]CC[C@@H]2CCC[NH2+]C2)cccc1[N+](=O)[O-] ZINC000423256903 238312217 /nfs/dbraw/zinc/31/22/17/238312217.db2.gz GONIVCIOOUNHBW-KBPBESRZSA-N 2 0 291.395 2.944 20 5 CFBDRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000093214811 375195818 /nfs/dbraw/zinc/19/58/18/375195818.db2.gz HWODEEVOLQUFFW-WCFLWFBJSA-N 2 0 263.341 2.515 20 5 CFBDRP O=[N+]([O-])c1ccccc1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000278478754 194002574 /nfs/dbraw/zinc/00/25/74/194002574.db2.gz JBKBLZNDSUWJPJ-UHFFFAOYSA-N 2 0 289.379 2.559 20 5 CFBDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)C1 ZINC000163262607 378963041 /nfs/dbraw/zinc/96/30/41/378963041.db2.gz RFWFKGHLCYYWFV-KBPBESRZSA-N 2 0 291.395 2.896 20 5 CFBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000358521090 380901273 /nfs/dbraw/zinc/90/12/73/380901273.db2.gz WWHDYXHSCDKBAD-ZDUSSCGKSA-N 2 0 289.379 2.731 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1CN[C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000368318717 380989160 /nfs/dbraw/zinc/98/91/60/380989160.db2.gz NSFDMRABPKPEGP-HUUCEWRRSA-N 2 0 289.379 2.620 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@H]1CCC[C@H]([NH3+])C1 ZINC000415006151 381698382 /nfs/dbraw/zinc/69/83/82/381698382.db2.gz PWKXOTWUYJMERH-JSGCOSHPSA-N 2 0 277.368 2.510 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@H]1CCC[C@@H]([NH3+])C1 ZINC000415006147 381698974 /nfs/dbraw/zinc/69/89/74/381698974.db2.gz PWKXOTWUYJMERH-GXTWGEPZSA-N 2 0 277.368 2.510 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)CC(C)(C)C[NH3+] ZINC000420287641 382341620 /nfs/dbraw/zinc/34/16/20/382341620.db2.gz IHGYCMQFGNKNGO-GFCCVEGCSA-N 2 0 279.384 2.881 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)cc1[N+](=O)[O-] ZINC000420397391 382397941 /nfs/dbraw/zinc/39/79/41/382397941.db2.gz GBPOQJSBLPCNFG-OLZOCXBDSA-N 2 0 277.368 2.553 20 5 CFBDRP Cc1c([C@H](C)[NH2+][C@H]2CCC[C@@H]([NH3+])C2)cccc1[N+](=O)[O-] ZINC000423363782 383064958 /nfs/dbraw/zinc/06/49/58/383064958.db2.gz AKRHOXPSZPHHIJ-XQQFMLRXSA-N 2 0 277.368 2.824 20 5 CFBDRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000423383798 383076204 /nfs/dbraw/zinc/07/62/04/383076204.db2.gz FGXPXNWZWQEKJR-BYCMXARLSA-N 2 0 277.368 2.634 20 5 CFBDRP Cc1c([C@H](C)[NH2+][C@H]2CC[NH2+]C[C@H]2C)cccc1[N+](=O)[O-] ZINC000423398895 383082312 /nfs/dbraw/zinc/08/23/12/383082312.db2.gz PEAJBEYLERJWTR-OSMZGAPFSA-N 2 0 277.368 2.552 20 5 CFBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)[C@@H](C)[NH3+] ZINC000423446070 383098987 /nfs/dbraw/zinc/09/89/87/383098987.db2.gz NQLLKSJJIQHDSP-IJLUTSLNSA-N 2 0 297.424 2.791 20 5 CFBDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)C1 ZINC000247123323 383145156 /nfs/dbraw/zinc/14/51/56/383145156.db2.gz RFWFKGHLCYYWFV-KGLIPLIRSA-N 2 0 291.395 2.896 20 5 CFBDRP [NH3+]CCN(CCc1ccccc1)Cc1cccc([N+](=O)[O-])c1 ZINC000261787485 383559780 /nfs/dbraw/zinc/55/97/80/383559780.db2.gz PYTGVDUVTKGTNF-UHFFFAOYSA-N 2 0 299.374 2.598 20 5 CFBDRP CC(C)[N@H+](C)CCCN[C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000574583741 384118913 /nfs/dbraw/zinc/11/89/13/384118913.db2.gz NEXBUNYDAZNCAK-OAHLLOKOSA-N 2 0 291.395 2.902 20 5 CFBDRP C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)[C@@H]1CCC[NH2+]C1 ZINC000422949627 533506543 /nfs/dbraw/zinc/50/65/43/533506543.db2.gz UPZRVUZDZAPPMU-OUCADQQQSA-N 2 0 277.368 2.634 20 5 CFBDRP C[C@@H]1C[C@@H]([NH2+]C/C=C/c2ccccc2[N+](=O)[O-])CC[N@@H+]1C ZINC000344610621 162080577 /nfs/dbraw/zinc/08/05/77/162080577.db2.gz AXBHVKDFBWOWQC-LGVMCUBASA-N 2 0 289.379 2.680 20 5 CFBDRP C[C@H]([NH3+])CC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000423222224 274503207 /nfs/dbraw/zinc/50/32/07/274503207.db2.gz AHOWHYURJJSLRZ-HZMBPMFUSA-N 2 0 277.368 2.644 20 5 CFBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1CCC([NH3+])CC1 ZINC000437776673 278236746 /nfs/dbraw/zinc/23/67/46/278236746.db2.gz OGNKVIOJISYSCN-GRTSSRMGSA-N 2 0 291.395 2.775 20 5 CFBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000423348126 278298501 /nfs/dbraw/zinc/29/85/01/278298501.db2.gz SQCKOKIKPICNOT-XJKSGUPXSA-N 2 0 291.395 2.505 20 5 CFBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000423278196 278298517 /nfs/dbraw/zinc/29/85/17/278298517.db2.gz QTEUHHUURXDISM-UONOGXRCSA-N 2 0 291.395 2.505 20 5 CFBDRP C[C@@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1ccc([N+](=O)[O-])cc1 ZINC000423260832 278348563 /nfs/dbraw/zinc/34/85/63/278348563.db2.gz QVZLNLXRCLBOGG-CHWSQXEVSA-N 2 0 277.368 2.635 20 5 CFBDRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000423438283 279255219 /nfs/dbraw/zinc/25/52/19/279255219.db2.gz RBRYDRFTECSWHU-VXGBXAGGSA-N 2 0 265.357 2.763 20 5 CFBDRP CC[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCC[NH2+]CC1 ZINC000435393399 281235034 /nfs/dbraw/zinc/23/50/34/281235034.db2.gz ZKTHGMYJPSFJGM-CQSZACIVSA-N 2 0 277.368 2.559 20 5 CFBDRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1ccccc1[N+](=O)[O-] ZINC000519564324 281308649 /nfs/dbraw/zinc/30/86/49/281308649.db2.gz WJVCEARTPRKKGH-TUAOUCFPSA-N 2 0 263.341 2.515 20 5 CFBDRP C[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])[C@H]1CCC[NH2+]C1 ZINC000414855014 533788078 /nfs/dbraw/zinc/78/80/78/533788078.db2.gz MRAXQHZIJQBUMZ-FRGQNTEPSA-N 2 0 289.379 2.586 20 5 CFBDRP Cc1c([C@@H](C)[NH2+][C@@H](C)CCC[NH3+])cccc1[N+](=O)[O-] ZINC000423454555 533947111 /nfs/dbraw/zinc/94/71/11/533947111.db2.gz LRRNUGBUPVYDPS-CMPLNLGQSA-N 2 0 265.357 2.681 20 5 CFBDRP C[C@H](C[NH3+])C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000414876997 534048821 /nfs/dbraw/zinc/04/88/21/534048821.db2.gz MGBJVNLLRRVIHO-LLVKDONJSA-N 2 0 289.335 2.539 20 5 CFBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000423477579 534254141 /nfs/dbraw/zinc/25/41/41/534254141.db2.gz KBGLLELMXKKZGP-ZFWWWQNUSA-N 2 0 291.395 2.648 20 5 CFBDRP C[C@H]([NH3+])C1CC[NH+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000261968453 619355566 /nfs/dbraw/zinc/35/55/66/619355566.db2.gz QBQAOBXVVJCPNU-JTQLQIEISA-N 2 0 297.786 2.807 20 5 CFBDRP C[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1ccccc1[N+](=O)[O-] ZINC000897464885 620177051 /nfs/dbraw/zinc/17/70/51/620177051.db2.gz PXOKVIBPWQEIGA-MCIONIFRSA-N 2 0 291.395 2.771 20 5 CFBDRP C[C@H](C[NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1ccccc1[N+](=O)[O-] ZINC000902429734 621076431 /nfs/dbraw/zinc/07/64/31/621076431.db2.gz NOHZSBIMURPRFO-FRRDWIJNSA-N 2 0 277.368 2.558 20 5 CFBDRP C[C@@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccc([N+](=O)[O-])cc1 ZINC000903987424 621499449 /nfs/dbraw/zinc/49/94/49/621499449.db2.gz GEAJOEAMRAVNIE-REBRKWNGSA-N 2 0 289.379 2.634 20 5 CFBDRP C[C@@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccc([N+](=O)[O-])cc1 ZINC000903987425 621499577 /nfs/dbraw/zinc/49/95/77/621499577.db2.gz GEAJOEAMRAVNIE-UQOMUDLDSA-N 2 0 289.379 2.634 20 5 CFBDRP CC(C)c1ccc(C[N@@H+]2CC[C@@H](CC[NH3+])C2)cc1[N+](=O)[O-] ZINC000904411301 621592362 /nfs/dbraw/zinc/59/23/62/621592362.db2.gz UIBPIGZMDMGENK-CYBMUJFWSA-N 2 0 291.395 2.889 20 5 CFBDRP C[C@H]1C[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC[C@H]1C[NH3+] ZINC000923496425 626476536 /nfs/dbraw/zinc/47/65/36/626476536.db2.gz IDZHDERHMCPFTB-QWRGUYRKSA-N 2 0 297.786 2.665 20 5 CFBDRP O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000841073088 631330292 /nfs/dbraw/zinc/33/02/92/631330292.db2.gz PVBFZQLMBAOGSM-CYBMUJFWSA-N 2 0 297.786 2.870 20 5 CFBDRP [NH3+]CCCCCC[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000843128589 631847557 /nfs/dbraw/zinc/84/75/57/631847557.db2.gz XXWLEUCTFXKLSK-UHFFFAOYSA-N 2 0 285.775 2.857 20 5 CFBDRP [NH3+]CCCCCC[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000843129436 631848591 /nfs/dbraw/zinc/84/85/91/631848591.db2.gz UEMIWXXMUJWVLS-UHFFFAOYSA-N 2 0 285.775 2.857 20 5 CFBDRP [NH3+]CC1CCC([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000817907926 632729253 /nfs/dbraw/zinc/72/92/53/632729253.db2.gz ZQGKNMWQSNTHLA-UHFFFAOYSA-N 2 0 297.786 2.855 20 5 CFBDRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000848563719 633290233 /nfs/dbraw/zinc/29/02/33/633290233.db2.gz WTPAFBMPHHHFJD-GSJFWJNXSA-N 2 0 297.786 2.678 20 5 CFBDRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872083042 641617221 /nfs/dbraw/zinc/61/72/21/641617221.db2.gz GICMQNHCEYHHQS-SDDRHHMPSA-N 2 0 295.358 2.725 20 5 CFBDRP Cc1ccc([N+](=O)[O-])c(C)c1CN[C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000873060294 641998414 /nfs/dbraw/zinc/99/84/14/641998414.db2.gz HOXQDKBHVXQYRA-GXTWGEPZSA-N 2 0 291.395 2.784 20 5 CFBDRP Cc1c(CN[C@H]2CCC[C@@H]([NH+](C)C)C2)cccc1[N+](=O)[O-] ZINC000873069560 642003242 /nfs/dbraw/zinc/00/32/42/642003242.db2.gz JYYLJZBRNCRHDF-LSDHHAIUSA-N 2 0 291.395 2.866 20 5 CFBDRP C[C@@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])C1CC[NH2+]CC1 ZINC000873221799 642075163 /nfs/dbraw/zinc/07/51/63/642075163.db2.gz QKOQOXFUTUTHBX-RYWCDNDXSA-N 2 0 289.379 2.586 20 5 CFBDRP C[C@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])C1CC[NH2+]CC1 ZINC000873222128 642075238 /nfs/dbraw/zinc/07/52/38/642075238.db2.gz APPPMFCTHNILJW-JTQLQIEISA-N 2 0 297.786 2.726 20 5 CFBDRP C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C1CC[NH2+]CC1 ZINC000873221629 642075313 /nfs/dbraw/zinc/07/53/13/642075313.db2.gz ZDSTUBXPPNRNCU-SNVBAGLBSA-N 2 0 297.786 2.726 20 5 CFBDRP CCC[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000873256511 642102671 /nfs/dbraw/zinc/10/26/71/642102671.db2.gz OQOSROZKEZAPQJ-LNSITVRQSA-N 2 0 277.368 2.763 20 5 CFBDRP C[C@@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccc([N+](=O)[O-])c1 ZINC000873259923 642104239 /nfs/dbraw/zinc/10/42/39/642104239.db2.gz OQKWRVKKGXAFHB-RJZRQDKASA-N 2 0 289.379 2.776 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@H](C)C2CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000873265606 642108881 /nfs/dbraw/zinc/10/88/81/642108881.db2.gz OQTLHHNVXDSPAK-OLZOCXBDSA-N 2 0 291.395 2.942 20 5 CFBDRP C[C@@H]1C[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1CC[NH3+] ZINC000723892562 770708096 /nfs/dbraw/zinc/70/80/96/770708096.db2.gz RZRXTNVUBQQPFI-GHMZBOCLSA-N 2 0 297.786 2.665 20 5 CFBDRP C[C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1OCC[N+](C)(C)C ZINC001224772033 775269699 /nfs/dbraw/zinc/26/96/99/775269699.db2.gz WIAAUBQJHYNSRQ-AEFFLSMTSA-N 2 0 291.459 2.620 20 5 CFBDRP Cc1cc(C)c([N+](=O)[O-])c(C)c1NC(=[NH2+])SCC[NH3+] ZINC001167914344 776567138 /nfs/dbraw/zinc/56/71/38/776567138.db2.gz KTKSDDOHUPDPSC-UHFFFAOYSA-N 2 0 282.369 2.559 20 5 CFBDRP CC[N+](C)(C)Cc1ccccc1NC1(C)CC[NH2+]CC1 ZINC001168186233 778228305 /nfs/dbraw/zinc/22/83/05/778228305.db2.gz VMQYSBQZRQTOJT-UHFFFAOYSA-N 2 0 276.448 2.837 20 5 CFBDRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000594520203 349441122 /nfs/dbraw/zinc/44/11/22/349441122.db2.gz IWGYQCUCKMOCBT-JBTXTNLTSA-N 2 0 289.379 2.538 20 5 CFBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](C)C[NH3+] ZINC000423311194 529418409 /nfs/dbraw/zinc/41/84/09/529418409.db2.gz SVTQZWLBAOHAAE-VXGBXAGGSA-N 2 0 297.424 2.650 20 5 CFBDRP C[C@@H]1CCC[N@H+](Cc2csc([N+](=O)[O-])c2)[C@@H]1CCC[NH3+] ZINC000595904639 349765324 /nfs/dbraw/zinc/76/53/24/349765324.db2.gz JMCCMRVHDMFCBX-DGCLKSJQSA-N 2 0 297.424 2.996 20 5 CFBDRP Cc1c(C[N@H+]2CCC[C@@H](C)[C@@H]2CC[NH3+])cccc1[N+](=O)[O-] ZINC000404382697 348591175 /nfs/dbraw/zinc/59/11/75/348591175.db2.gz NCMZXYMDCYCQBX-DOMZBBRYSA-N 2 0 291.395 2.853 20 5 CFBDRP CC[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1cccc([N+](=O)[O-])c1 ZINC000591579271 349032238 /nfs/dbraw/zinc/03/22/38/349032238.db2.gz FMFNJARWDHPLTK-HUUCEWRRSA-N 2 0 289.379 2.778 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000601969291 350821754 /nfs/dbraw/zinc/82/17/54/350821754.db2.gz BLTODOUJAYQYTM-AWEZNQCLSA-N 2 0 291.395 2.771 20 5 CFBDRP Cc1cc(NC[C@@H](C)[NH+](C)C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000122198749 187020619 /nfs/dbraw/zinc/02/06/19/187020619.db2.gz ZIKRNMGEGBLUMW-LLVKDONJSA-N 2 0 288.351 2.813 20 5 CFBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423330201 238381023 /nfs/dbraw/zinc/38/10/23/238381023.db2.gz NKJSJSRQZIKXJJ-CYBMUJFWSA-N 2 0 291.395 2.505 20 5 CFBDRP Cc1c([C@@H](C)[NH2+]C[C@]2(C)CCC[NH2+]C2)cccc1[N+](=O)[O-] ZINC000423346302 238396102 /nfs/dbraw/zinc/39/61/02/238396102.db2.gz ZSJZEHACFUJNJU-CZUORRHYSA-N 2 0 291.395 2.944 20 5 CFBDRP CC[N@H+](Cc1cccc([N+](=O)[O-])c1C)[C@@H]1CCC[NH2+]CC1 ZINC000435613487 240331064 /nfs/dbraw/zinc/33/10/64/240331064.db2.gz KDQWEVOZVJTRPU-OAHLLOKOSA-N 2 0 291.395 2.867 20 5 CFBDRP [NH3+]CC[C@H]1CCC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000070171026 374137859 /nfs/dbraw/zinc/13/78/59/374137859.db2.gz HMZGWGASYFMYBO-LLVKDONJSA-N 2 0 297.786 2.809 20 5 CFBDRP Cc1c(CN(C)CC[C@@H]([NH3+])C(C)C)cccc1[N+](=O)[O-] ZINC000128482613 377341092 /nfs/dbraw/zinc/34/10/92/377341092.db2.gz UKIKTYNNFCPQDO-CQSZACIVSA-N 2 0 279.384 2.708 20 5 CFBDRP Cc1ccc(C[NH2+][C@@H](C)CCCC[NH3+])cc1[N+](=O)[O-] ZINC000415016003 381710205 /nfs/dbraw/zinc/71/02/05/381710205.db2.gz OSXVIWGXFYYEHL-LBPRGKRZSA-N 2 0 265.357 2.510 20 5 CFBDRP C[C@H](CCCC[NH3+])[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000415016899 381711919 /nfs/dbraw/zinc/71/19/19/381711919.db2.gz QOLVYFUSJIEHMA-YSKGHYERSA-N 2 0 277.368 2.715 20 5 CFBDRP [NH3+][C@@H]1CCC[C@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000414995488 381686438 /nfs/dbraw/zinc/68/64/38/381686438.db2.gz FTPBRWHZEWHHMY-CMPLNLGQSA-N 2 0 297.786 2.855 20 5 CFBDRP C[C@H](C[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-])C[NH+](C)C ZINC000293815272 382289895 /nfs/dbraw/zinc/28/98/95/382289895.db2.gz VUAMZTCDTAWENB-KGLIPLIRSA-N 2 0 293.411 2.703 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1 ZINC000420314336 382362403 /nfs/dbraw/zinc/36/24/03/382362403.db2.gz VOZSHEFNIRAPBG-GVAFMPQTSA-N 2 0 289.379 2.633 20 5 CFBDRP [NH3+]CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)CC1CCCC1 ZINC000352519935 382378267 /nfs/dbraw/zinc/37/82/67/382378267.db2.gz SXBDWNKSTCAZFI-UHFFFAOYSA-N 2 0 291.395 2.936 20 5 CFBDRP CC[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1cccc([N+](=O)[O-])c1 ZINC000420397863 382398366 /nfs/dbraw/zinc/39/83/66/382398366.db2.gz GMYYAEPGXBVSSA-DOMZBBRYSA-N 2 0 277.368 2.635 20 5 CFBDRP C[C@H](CCC[NH3+])[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000423045446 383028830 /nfs/dbraw/zinc/02/88/30/383028830.db2.gz SBKXNJAFTAAEOH-SNVBAGLBSA-N 2 0 285.775 2.508 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H]([NH3+])C2)cc1[N+](=O)[O-] ZINC000423393631 383079381 /nfs/dbraw/zinc/07/93/81/383079381.db2.gz QSZOVAOVPZXWLA-YUTCNCBUSA-N 2 0 277.368 2.824 20 5 CFBDRP Cc1c([C@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])C2)cccc1[N+](=O)[O-] ZINC000423496392 383121593 /nfs/dbraw/zinc/12/15/93/383121593.db2.gz WTQHCQIEMJPNFS-AVGNSLFASA-N 2 0 277.368 2.681 20 5 CFBDRP CC[C@@H]([NH3+])C[NH2+][C@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000423458776 383103128 /nfs/dbraw/zinc/10/31/28/383103128.db2.gz HGPPUPOZHVDLBC-VXGBXAGGSA-N 2 0 297.424 2.792 20 5 CFBDRP C[C@H](CCC[NH3+])[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000423464958 383105795 /nfs/dbraw/zinc/10/57/95/383105795.db2.gz WCMZBFNDHPMWFG-IUODEOHRSA-N 2 0 291.395 2.633 20 5 CFBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424367400 383204853 /nfs/dbraw/zinc/20/48/53/383204853.db2.gz LXCXTWRVVMYJHA-NWANDNLSSA-N 2 0 291.395 2.775 20 5 CFBDRP C[NH+](C)[C@@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000277154737 384216626 /nfs/dbraw/zinc/21/66/26/384216626.db2.gz JVBXAOVDPOMTMD-OAHLLOKOSA-N 2 0 291.395 2.553 20 5 CFBDRP C[C@@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[NH2+]1 ZINC000422920626 533380096 /nfs/dbraw/zinc/38/00/96/533380096.db2.gz MJEOXGKTCVNMEE-CZUORRHYSA-N 2 0 291.395 2.648 20 5 CFBDRP CC[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000423564700 394298220 /nfs/dbraw/zinc/29/82/20/394298220.db2.gz SBAOYTQGYCSHSA-INIZCTEOSA-N 2 0 289.379 2.945 20 5 CFBDRP O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000250019211 296504132 /nfs/dbraw/zinc/50/41/32/296504132.db2.gz ZWGLEMANQZBUNB-BZUAXINKSA-N 2 0 289.379 2.605 20 5 CFBDRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)[C@H]2CCC[C@H]21 ZINC000375801582 157287279 /nfs/dbraw/zinc/28/72/79/157287279.db2.gz LYOURIGMBOJKPL-OWCLPIDISA-N 2 0 289.379 2.557 20 5 CFBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCCC[NH+](C)C ZINC000344827600 162129556 /nfs/dbraw/zinc/12/95/56/162129556.db2.gz BSURIZJNLUWCHQ-KAMYIIQDSA-N 2 0 291.395 2.930 20 5 CFBDRP C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(C[NH+](C)C)CC1 ZINC000350917127 163112109 /nfs/dbraw/zinc/11/21/09/163112109.db2.gz HXWXTEPVDMJAAI-ZDUSSCGKSA-N 2 0 291.395 2.929 20 5 CFBDRP CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC[NH2+]CC1 ZINC000037538962 173258535 /nfs/dbraw/zinc/25/85/35/173258535.db2.gz YYCRRVLIVUOVKR-UHFFFAOYSA-N 2 0 277.368 2.559 20 5 CFBDRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000044515980 175189949 /nfs/dbraw/zinc/18/99/49/175189949.db2.gz ZPKVFZNAFGEDCC-GFCCVEGCSA-N 2 0 277.368 2.587 20 5 CFBDRP CC[C@H]([NH2+]CC1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000044515861 175190093 /nfs/dbraw/zinc/19/00/93/175190093.db2.gz XWIMRASRORWSSK-INIZCTEOSA-N 2 0 291.395 2.977 20 5 CFBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000414826858 533682450 /nfs/dbraw/zinc/68/24/50/533682450.db2.gz GISKACJVPDGZHT-KBPBESRZSA-N 2 0 291.395 2.505 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1CC[NH2+]CC1 ZINC000517024065 270395712 /nfs/dbraw/zinc/39/57/12/270395712.db2.gz XXCAFWFONQEOLW-CYBMUJFWSA-N 2 0 291.395 2.505 20 5 CFBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)CCC2 ZINC000423247045 275037934 /nfs/dbraw/zinc/03/79/34/275037934.db2.gz KOBHCRZSKBWEPO-LRDDRELGSA-N 2 0 289.379 2.561 20 5 CFBDRP C[C@@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000414181084 278348485 /nfs/dbraw/zinc/34/84/85/278348485.db2.gz MMLJJJYWOUBHIY-ZIAGYGMSSA-N 2 0 291.395 2.977 20 5 CFBDRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000423471700 279256149 /nfs/dbraw/zinc/25/61/49/279256149.db2.gz ZRFDWXNZFQTPIV-IAQYHMDHSA-N 2 0 277.368 2.689 20 5 CFBDRP C[C@H]([NH2+]C1CCC(C[NH3+])CC1)c1ccc([N+](=O)[O-])cc1 ZINC000423145817 289937469 /nfs/dbraw/zinc/93/74/69/289937469.db2.gz MQPSGVBQXHJGMB-DCBWTQNWSA-N 2 0 277.368 2.763 20 5 CFBDRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000565783497 290325480 /nfs/dbraw/zinc/32/54/80/290325480.db2.gz BAJWKSDWANSDSN-CABCVRRESA-N 2 0 291.395 2.777 20 5 CFBDRP [NH3+]CCCC[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000414915296 295229033 /nfs/dbraw/zinc/22/90/33/295229033.db2.gz YYAJKZYXSGNNDU-DZGCQCFKSA-N 2 0 291.395 2.635 20 5 CFBDRP CC[NH2+]CCCN[C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000582719802 325228048 /nfs/dbraw/zinc/22/80/48/325228048.db2.gz QFSCEZMDRDXSHP-HNNXBMFYSA-N 2 0 277.368 2.561 20 5 CFBDRP Cc1ccc(C[NH2+]CC2(C)CC[NH+](C)CC2)cc1[N+](=O)[O-] ZINC000227329413 524572264 /nfs/dbraw/zinc/57/22/64/524572264.db2.gz TVIGBZPLIBEIJR-UHFFFAOYSA-N 2 0 291.395 2.725 20 5 CFBDRP CCOc1ccc([C@@H](C)[NH2+][C@H](C)CCC[NH3+])cc1[N+](=O)[O-] ZINC000423467334 528598400 /nfs/dbraw/zinc/59/84/00/528598400.db2.gz XKNBOEHXCMGZNT-VXGBXAGGSA-N 2 0 295.383 2.772 20 5 CFBDRP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccccc1[N+](=O)[O-] ZINC000897464886 620176977 /nfs/dbraw/zinc/17/69/77/620176977.db2.gz PXOKVIBPWQEIGA-MGPQQGTHSA-N 2 0 291.395 2.771 20 5 CFBDRP CC1(C)C[NH2+]CC[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000902315787 621030836 /nfs/dbraw/zinc/03/08/36/621030836.db2.gz DJJACPOTNLEZFK-CQSZACIVSA-N 2 0 291.395 2.505 20 5 CFBDRP C[C@@H]1C[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C[C@H]1CC[NH3+] ZINC000903497312 621395505 /nfs/dbraw/zinc/39/55/05/621395505.db2.gz VINCIAWWUSXVGH-GHMZBOCLSA-N 2 0 297.786 2.665 20 5 CFBDRP C[C@@H]1C[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])CC[C@H]1C[NH3+] ZINC000904410708 621591982 /nfs/dbraw/zinc/59/19/82/621591982.db2.gz FTONZDSFZHNKIM-HNLSUCLVSA-N 2 0 289.379 2.525 20 5 CFBDRP C[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC[C@H]1C[NH3+] ZINC000904411996 621593507 /nfs/dbraw/zinc/59/35/07/621593507.db2.gz YUXCITHDBUVPSA-JQWIXIFHSA-N 2 0 297.786 2.665 20 5 CFBDRP Cc1c(C[N@@H+]2CCCC[C@H]2CC[NH3+])cccc1[N+](=O)[O-] ZINC000070149477 625273736 /nfs/dbraw/zinc/27/37/36/625273736.db2.gz JBXDERMQLQNNBT-AWEZNQCLSA-N 2 0 277.368 2.607 20 5 CFBDRP C[C@H]1C[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC[C@@H]1C[NH3+] ZINC000923499204 626477487 /nfs/dbraw/zinc/47/74/87/626477487.db2.gz RHHBADVGRISYGJ-WDEREUQCSA-N 2 0 297.786 2.665 20 5 CFBDRP C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C1CCC([NH3+])CC1 ZINC000843055538 626549532 /nfs/dbraw/zinc/54/95/32/626549532.db2.gz GLMGKOHGSYCXGV-UHFFFAOYSA-N 2 0 297.786 2.950 20 5 CFBDRP CC[NH+]1CCC(NCc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000761515787 626841554 /nfs/dbraw/zinc/84/15/54/626841554.db2.gz LSUOVHJOPYJIBB-UHFFFAOYSA-N 2 0 297.786 2.822 20 5 CFBDRP C[N@@H+](Cc1c2ccccc2cc2ccccc21)C[C@H](O)C[NH3+] ZINC000841093938 631338764 /nfs/dbraw/zinc/33/87/64/631338764.db2.gz VUPHOCYXBIAZPE-MRXNPFEDSA-N 2 0 294.398 2.744 20 5 CFBDRP C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CCCC[NH+](C)C ZINC000866250300 638780023 /nfs/dbraw/zinc/78/00/23/638780023.db2.gz YDMZRZIKTGQPFJ-LBPRGKRZSA-N 2 0 297.374 2.596 20 5 CFBDRP O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000093452421 650940361 /nfs/dbraw/zinc/94/03/61/650940361.db2.gz ZWGLEMANQZBUNB-HRCADAONSA-N 2 0 289.379 2.605 20 5 CFBDRP C[N@H+](CCCCCC[NH3+])Cc1ccc([N+](=O)[O-])cc1F ZINC000710694767 781334785 /nfs/dbraw/zinc/33/47/85/781334785.db2.gz QAJXFCKETGPUTK-UHFFFAOYSA-N 2 0 283.347 2.685 20 5 CFBDRP C[NH2+]C[C@H](C)[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000596105315 349795337 /nfs/dbraw/zinc/79/53/37/349795337.db2.gz KCDCBAGIJPPXPH-GZBFAFLISA-N 2 0 291.395 2.504 20 5 CFBDRP CCC[NH+]1CCC([NH2+]CCc2ccccc2[N+](=O)[O-])CC1 ZINC000062726467 346690625 /nfs/dbraw/zinc/69/06/25/346690625.db2.gz NIYZOSJEEQHOOM-UHFFFAOYSA-N 2 0 291.395 2.601 20 5 CFBDRP Cc1c([C@@H](C)[NH2+][C@H]2CC23CC[NH2+]CC3)cccc1[N+](=O)[O-] ZINC000591579359 349032215 /nfs/dbraw/zinc/03/22/15/349032215.db2.gz OEKPEGKJONRCNA-DOMZBBRYSA-N 2 0 289.379 2.696 20 5 CFBDRP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000414170018 233185942 /nfs/dbraw/zinc/18/59/42/233185942.db2.gz BLPUCVHDNPXRRD-KBPBESRZSA-N 2 0 291.395 2.977 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC1(C[NH3+])CC1 ZINC000593314216 349245794 /nfs/dbraw/zinc/24/57/94/349245794.db2.gz BNSIOTCQWIOORS-CYBMUJFWSA-N 2 0 291.395 2.635 20 5 CFBDRP C[C@@H](NC[C@@H]1CCCC[N@H+](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000599070033 350370048 /nfs/dbraw/zinc/37/00/48/350370048.db2.gz JOZKRORIJBJQFN-KGLIPLIRSA-N 2 0 291.395 2.977 20 5 CFBDRP C[C@@H]([NH3+])C1CC[NH+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000110644338 186308600 /nfs/dbraw/zinc/30/86/00/186308600.db2.gz NDKRYGWRFOCPKP-NEPJUHHUSA-N 2 0 277.368 2.715 20 5 CFBDRP C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC([C@H](C)[NH3+])CC1 ZINC000110645195 186308852 /nfs/dbraw/zinc/30/88/52/186308852.db2.gz FTJAFYHORHYZIZ-NWDGAFQWSA-N 2 0 277.368 2.715 20 5 CFBDRP Cc1ccc(C[NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)cc1[N+](=O)[O-] ZINC000601973629 350822679 /nfs/dbraw/zinc/82/26/79/350822679.db2.gz SBHXGJUUBRCXDS-CQSZACIVSA-N 2 0 291.395 2.771 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1C[C@H]([NH3+])C1(C)C ZINC000603431711 351163837 /nfs/dbraw/zinc/16/38/37/351163837.db2.gz GJNPGBZDGTWTRA-LEWSCRJBSA-N 2 0 277.368 2.680 20 5 CFBDRP Cc1c([C@H](C)[NH2+]CC2=CC[N@H+](C)CC2)cccc1[N+](=O)[O-] ZINC000271807965 191340915 /nfs/dbraw/zinc/34/09/15/191340915.db2.gz ADSNAQPLHQWSSN-ZDUSSCGKSA-N 2 0 289.379 2.816 20 5 CFBDRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000422916231 237344939 /nfs/dbraw/zinc/34/49/39/237344939.db2.gz CXFRIXISEYZQOA-QWHCGFSZSA-N 2 0 279.384 2.633 20 5 CFBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1 ZINC000423216480 238283020 /nfs/dbraw/zinc/28/30/20/238283020.db2.gz ONAZWIANODMFEY-VNHYZAJKSA-N 2 0 291.395 2.504 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+]C[C@@]2(C)CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000423332179 238383049 /nfs/dbraw/zinc/38/30/49/238383049.db2.gz PBRGXDLFFUQGLM-BBRMVZONSA-N 2 0 291.395 2.944 20 5 CFBDRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1C[NH3+])c1ccc([N+](=O)[O-])cc1 ZINC000423278257 299369111 /nfs/dbraw/zinc/36/91/11/299369111.db2.gz QLMXTPVBZKMMTA-CORIIIEPSA-N 2 0 277.368 2.763 20 5 CFBDRP O=[N+]([O-])c1ccccc1/C=C/C[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000414967113 381663622 /nfs/dbraw/zinc/66/36/22/381663622.db2.gz GVUSMNKBVFLGAO-MIOHMZDASA-N 2 0 289.379 2.730 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+]CC2=CC[N@H+](C)CC2)cc1[N+](=O)[O-] ZINC000344293788 382256523 /nfs/dbraw/zinc/25/65/23/382256523.db2.gz RBTXMDUEIUPCBL-CYBMUJFWSA-N 2 0 289.379 2.816 20 5 CFBDRP CC[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1 ZINC000420415769 382403275 /nfs/dbraw/zinc/40/32/75/382403275.db2.gz VFRKJXDBEFWNDS-WFASDCNBSA-N 2 0 277.368 2.635 20 5 CFBDRP CC(C)[C@H]([NH3+])CC[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000346693379 382478050 /nfs/dbraw/zinc/47/80/50/382478050.db2.gz MRZAASLRAXXNNB-PMGBHYCQSA-N 2 0 291.395 2.913 20 5 CFBDRP C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CC(C)(C)C[NH3+] ZINC000346693911 382478269 /nfs/dbraw/zinc/47/82/69/382478269.db2.gz QNAYBJHSTOZEKJ-VURMDHGXSA-N 2 0 277.368 2.525 20 5 CFBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000386367742 382588223 /nfs/dbraw/zinc/58/82/23/382588223.db2.gz OQJLEAYCSWPSBB-MCIONIFRSA-N 2 0 289.379 2.587 20 5 CFBDRP C[C@H](c1ccccc1[N+](=O)[O-])N1[C@@H]2CC[C@H]1CC[N@@H+](C)C2 ZINC000577579438 382863531 /nfs/dbraw/zinc/86/35/31/382863531.db2.gz MTIQTQWPOUCPFH-HZSPNIEDSA-N 2 0 289.379 2.824 20 5 CFBDRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000423047050 383028365 /nfs/dbraw/zinc/02/83/65/383028365.db2.gz UOHXDLLIKHKGOZ-VHSXEESVSA-N 2 0 285.775 2.506 20 5 CFBDRP CC1(C)C[C@H]([NH2+]CCCC[NH3+])c2cc([N+](=O)[O-])ccc21 ZINC000423343432 383060166 /nfs/dbraw/zinc/06/01/66/383060166.db2.gz ZUELBVVJTYILST-AWEZNQCLSA-N 2 0 277.368 2.646 20 5 CFBDRP CC(C)[C@@H]([NH3+])CC[N@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000251338662 383386929 /nfs/dbraw/zinc/38/69/29/383386929.db2.gz PROVUIDREKXPSV-DOMZBBRYSA-N 2 0 279.384 2.961 20 5 CFBDRP C[C@H]1CC2(C[N@@H+]1Cc1ccccc1[N+](=O)[O-])CC[NH2+]CC2 ZINC000572713242 383809194 /nfs/dbraw/zinc/80/91/94/383809194.db2.gz YGVSBACFHABEBQ-ZDUSSCGKSA-N 2 0 289.379 2.559 20 5 CFBDRP CN(CCC[NH+]1CCCC1)Cc1ccccc1[N+](=O)[O-] ZINC000193469102 393653506 /nfs/dbraw/zinc/65/35/06/393653506.db2.gz HIZQORRAENFASM-UHFFFAOYSA-N 2 0 277.368 2.513 20 5 CFBDRP CC[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000423389000 394280052 /nfs/dbraw/zinc/28/00/52/394280052.db2.gz NXEOQLBGQSFBKO-GUTXKFCHSA-N 2 0 277.368 2.905 20 5 CFBDRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)[C@@H]2CCC[C@@H]21 ZINC000375801581 157287312 /nfs/dbraw/zinc/28/73/12/157287312.db2.gz LYOURIGMBOJKPL-JYJNAYRXSA-N 2 0 289.379 2.557 20 5 CFBDRP CCC[N@H+](Cc1cccc([N+](=O)[O-])c1C)C1CC[NH2+]CC1 ZINC000037539302 173260027 /nfs/dbraw/zinc/26/00/27/173260027.db2.gz SRZQLNQIRIVBNO-UHFFFAOYSA-N 2 0 291.395 2.867 20 5 CFBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)CCC2 ZINC000423216086 275037861 /nfs/dbraw/zinc/03/78/61/275037861.db2.gz RKMLPDPEDSTABE-WBMJQRKESA-N 2 0 289.379 2.561 20 5 CFBDRP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc([N+](=O)[O-])cc1 ZINC000423480988 278346357 /nfs/dbraw/zinc/34/63/57/278346357.db2.gz NWPRENDJPIUFJO-OCCSQVGLSA-N 2 0 277.368 2.778 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1CCC([NH3+])CC1 ZINC000437776674 279275166 /nfs/dbraw/zinc/27/51/66/279275166.db2.gz OGNKVIOJISYSCN-LRVUVFPRSA-N 2 0 291.395 2.775 20 5 CFBDRP C[C@H]([NH2+]C1CCC([NH3+])CC1)c1ccc([N+](=O)[O-])cc1 ZINC000051692816 289937793 /nfs/dbraw/zinc/93/77/93/289937793.db2.gz ABIWBKMSNBZRCQ-PKSQDBQZSA-N 2 0 263.341 2.515 20 5 CFBDRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccc([N+](=O)[O-])cc1 ZINC000423538390 290025054 /nfs/dbraw/zinc/02/50/54/290025054.db2.gz GEAJOEAMRAVNIE-PMOUVXMZSA-N 2 0 289.379 2.634 20 5 CFBDRP Cc1c([C@H](C)[NH2+]CC2CC[NH2+]CC2)cccc1[N+](=O)[O-] ZINC000576861468 324667711 /nfs/dbraw/zinc/66/77/11/324667711.db2.gz UEGJSPKTJBBKAN-LBPRGKRZSA-N 2 0 277.368 2.553 20 5 CFBDRP [NH3+]CCCC[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000414915300 534606629 /nfs/dbraw/zinc/60/66/29/534606629.db2.gz YYAJKZYXSGNNDU-ZFWWWQNUSA-N 2 0 291.395 2.635 20 5 CFBDRP C[NH+]1CCC(C)(C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000313780307 523753313 /nfs/dbraw/zinc/75/33/13/523753313.db2.gz AOQQHNULUHYXEU-UHFFFAOYSA-N 2 0 295.358 2.555 20 5 CFBDRP CC[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000423564712 529160212 /nfs/dbraw/zinc/16/02/12/529160212.db2.gz SBAOYTQGYCSHSA-MRXNPFEDSA-N 2 0 289.379 2.945 20 5 CFBDRP [NH3+][C@H]1C[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000262333899 619843400 /nfs/dbraw/zinc/84/34/00/619843400.db2.gz SSDCJNVNYUOZGR-DLBZAZTESA-N 2 0 297.358 2.872 20 5 CFBDRP C[C@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1[N+](=O)[O-] ZINC000902432694 621078417 /nfs/dbraw/zinc/07/84/17/621078417.db2.gz WIZHLCCPLRIEPC-HABKJSAYSA-N 2 0 289.379 2.571 20 5 CFBDRP CC(C)c1ccc(C[NH2+]C[C@@H]2C[NH2+]C[C@H]2C)cc1[N+](=O)[O-] ZINC000903965124 621496198 /nfs/dbraw/zinc/49/61/98/621496198.db2.gz WHCPOVOVUXUYQE-OCCSQVGLSA-N 2 0 291.395 2.663 20 5 CFBDRP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000841057097 631324294 /nfs/dbraw/zinc/32/42/94/631324294.db2.gz HYMMIUABERACRS-GHMZBOCLSA-N 2 0 283.759 2.608 20 5 CFBDRP C[C@H](CC[NH+](C)C)[NH2+][C@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866249604 638779996 /nfs/dbraw/zinc/77/99/96/638779996.db2.gz LWSAMKWRPSLWPN-VXGBXAGGSA-N 2 0 297.374 2.595 20 5 CFBDRP Cc1ccc([N+](=O)[O-])c(C)c1CN[C@H]1CC[N@H+](C)[C@H](C)C1 ZINC000873060296 641998730 /nfs/dbraw/zinc/99/87/30/641998730.db2.gz HOXQDKBHVXQYRA-OCCSQVGLSA-N 2 0 291.395 2.784 20 5 CFBDRP C[C@@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1ccccc1[N+](=O)[O-] ZINC000873297331 642128033 /nfs/dbraw/zinc/12/80/33/642128033.db2.gz WJVCEARTPRKKGH-WOPDTQHZSA-N 2 0 263.341 2.515 20 5 CFBDRP C[C@@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccccc1[N+](=O)[O-] ZINC000873297601 642128478 /nfs/dbraw/zinc/12/84/78/642128478.db2.gz YITYBBZAQICSAM-YIYPIFLZSA-N 2 0 289.379 2.634 20 5 CFBDRP C[C@H]([NH3+])[C@@H](NCCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000925631707 648251149 /nfs/dbraw/zinc/25/11/49/648251149.db2.gz WRUIRXFTHLNMKG-SUMWQHHRSA-N 2 0 299.374 2.815 20 5 CFBDRP Cc1ccc(C[NH2+][C@H]2C[C@H]([NH3+])CC(C)(C)C2)cc1[N+](=O)[O-] ZINC000925735818 648302891 /nfs/dbraw/zinc/30/28/91/648302891.db2.gz YBZYBLYUDCUIHJ-KBPBESRZSA-N 2 0 291.395 2.899 20 5 CFBDRP C[N@H+](CCCCCC[NH3+])Cc1ccc([N+](=O)[O-])cc1 ZINC000710819292 781340101 /nfs/dbraw/zinc/34/01/01/781340101.db2.gz OICBVDGDLZZIKN-UHFFFAOYSA-N 2 0 265.357 2.546 20 5 CFBDRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000594509015 349434570 /nfs/dbraw/zinc/43/45/70/349434570.db2.gz GRAMGSHPISJNGL-ZOWXZIJZSA-N 2 0 289.379 2.512 20 5 CFBDRP C[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H]1CCC[NH3+] ZINC000595905024 349765546 /nfs/dbraw/zinc/76/55/46/349765546.db2.gz OIUZDGLAPOTVBT-CZUORRHYSA-N 2 0 291.395 2.934 20 5 CFBDRP C[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H]1CC[NH3+] ZINC000404444382 348592638 /nfs/dbraw/zinc/59/26/38/348592638.db2.gz WJUJHJLWKXZCNN-WFASDCNBSA-N 2 0 277.368 2.544 20 5 CFBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@H]1CCC[NH2+]CC1)CCC2 ZINC000591578351 349031543 /nfs/dbraw/zinc/03/15/43/349031543.db2.gz VQQMGEPITTZOQX-BBRMVZONSA-N 2 0 289.379 2.704 20 5 CFBDRP Cc1c([C@@H](C)[NH2+][C@@H]2CC23CC[NH2+]CC3)cccc1[N+](=O)[O-] ZINC000591579361 349031968 /nfs/dbraw/zinc/03/19/68/349031968.db2.gz OEKPEGKJONRCNA-IUODEOHRSA-N 2 0 289.379 2.696 20 5 CFBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)CCC2 ZINC000591578353 349032285 /nfs/dbraw/zinc/03/22/85/349032285.db2.gz VQQMGEPITTZOQX-CZUORRHYSA-N 2 0 289.379 2.704 20 5 CFBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC1(C[NH3+])CC1 ZINC000593314218 349245511 /nfs/dbraw/zinc/24/55/11/349245511.db2.gz BNSIOTCQWIOORS-ZDUSSCGKSA-N 2 0 291.395 2.635 20 5 CFBDRP C[C@@H](NC[C@H]1CCCC[N@H+](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000599070037 350370248 /nfs/dbraw/zinc/37/02/48/350370248.db2.gz JOZKRORIJBJQFN-ZIAGYGMSSA-N 2 0 291.395 2.977 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@H](C[NH3+])[C@@H](C)C[C@@H]1C ZINC000422560815 237103930 /nfs/dbraw/zinc/10/39/30/237103930.db2.gz HRQFFFYSXGTTAC-WHOFXGATSA-N 2 0 291.395 2.708 20 5 CFBDRP [NH3+][C@H]1C[C@@H]([NH2+]CCc2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000422778566 237195742 /nfs/dbraw/zinc/19/57/42/237195742.db2.gz ASMWFIKXXCVFNM-JKSUJKDBSA-N 2 0 297.358 2.872 20 5 CFBDRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000422916229 237340026 /nfs/dbraw/zinc/34/00/26/237340026.db2.gz CXFRIXISEYZQOA-CHWSQXEVSA-N 2 0 279.384 2.633 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+][C@@H](C)CCC[NH3+])cc1[N+](=O)[O-] ZINC000422917966 237346353 /nfs/dbraw/zinc/34/63/53/237346353.db2.gz GKUUFAWZGNGQEL-NWDGAFQWSA-N 2 0 265.357 2.681 20 5 CFBDRP Cc1c([C@H](C)[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)cccc1[N+](=O)[O-] ZINC000423496519 238496893 /nfs/dbraw/zinc/49/68/93/238496893.db2.gz WTQHCQIEMJPNFS-YNEHKIRRSA-N 2 0 277.368 2.681 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@H]2CC[C@@H](C[NH3+])C2)cc1[N+](=O)[O-] ZINC000423489763 238491461 /nfs/dbraw/zinc/49/14/61/238491461.db2.gz GPVLNMIQOYWNLE-SCRDCRAPSA-N 2 0 277.368 2.681 20 5 CFBDRP C[C@H]([NH2+][C@H]1CCCC[C@@H]1C[NH3+])c1ccc([N+](=O)[O-])cc1 ZINC000423278258 299417327 /nfs/dbraw/zinc/41/73/27/299417327.db2.gz QLMXTPVBZKMMTA-LNSITVRQSA-N 2 0 277.368 2.763 20 5 CFBDRP C[NH2+]CC1CC[NH+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000063158889 373788032 /nfs/dbraw/zinc/78/80/32/373788032.db2.gz YHNWWSHGKNKAFF-GFCCVEGCSA-N 2 0 277.368 2.587 20 5 CFBDRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000093214813 375198150 /nfs/dbraw/zinc/19/81/50/375198150.db2.gz HWODEEVOLQUFFW-DRZSPHRISA-N 2 0 263.341 2.515 20 5 CFBDRP CC[NH2+]CC1CC[NH+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000129870502 377482951 /nfs/dbraw/zinc/48/29/51/377482951.db2.gz UVXNJNPFJFSZJU-ZDUSSCGKSA-N 2 0 291.395 2.977 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)cc1[N+](=O)[O-] ZINC000420397390 382397460 /nfs/dbraw/zinc/39/74/60/382397460.db2.gz GBPOQJSBLPCNFG-CHWSQXEVSA-N 2 0 277.368 2.553 20 5 CFBDRP CC[C@H]([NH2+][C@H]1CC[C@@H](C[NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000423497239 383121380 /nfs/dbraw/zinc/12/13/80/383121380.db2.gz YNBOPMOWVJKKIP-ZLDLUXBVSA-N 2 0 277.368 2.763 20 5 CFBDRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000423513817 383124854 /nfs/dbraw/zinc/12/48/54/383124854.db2.gz RONNBCIIBFATLX-AXAPSJFSSA-N 2 0 289.379 2.689 20 5 CFBDRP C[C@@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000423428778 383092661 /nfs/dbraw/zinc/09/26/61/383092661.db2.gz GTLZWMFEXWUDNX-XFBWCDHKSA-N 2 0 289.379 2.634 20 5 CFBDRP Cc1c([C@H](C)[NH2+][C@@H](C)CCC[NH3+])cccc1[N+](=O)[O-] ZINC000423454556 383101758 /nfs/dbraw/zinc/10/17/58/383101758.db2.gz LRRNUGBUPVYDPS-JQWIXIFHSA-N 2 0 265.357 2.681 20 5 CFBDRP C[C@@H](CCC[NH3+])[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000423464959 383105954 /nfs/dbraw/zinc/10/59/54/383105954.db2.gz WCMZBFNDHPMWFG-SWLSCSKDSA-N 2 0 291.395 2.633 20 5 CFBDRP C[N@@H+]1CCC[C@H]2CN(Cc3cccc([N+](=O)[O-])c3)CC[C@H]21 ZINC000248005405 383205900 /nfs/dbraw/zinc/20/59/00/383205900.db2.gz KUEKHMYWLVJCRK-GOEBONIOSA-N 2 0 289.379 2.511 20 5 CFBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000431042075 383625396 /nfs/dbraw/zinc/62/53/96/383625396.db2.gz CIMYOVVMKJBQOZ-CYBMUJFWSA-N 2 0 289.379 2.731 20 5 CFBDRP C[N@H+](CCCC[NH2+]Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000453604306 383871488 /nfs/dbraw/zinc/87/14/88/383871488.db2.gz ZAQISQCVWCACEZ-UHFFFAOYSA-N 2 0 277.368 2.559 20 5 CFBDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000249370153 131121328 /nfs/dbraw/zinc/12/13/28/131121328.db2.gz ADUDLOGLTKLQOT-KGLIPLIRSA-N 2 0 291.395 2.896 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+]CCC2=CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000423542865 394294855 /nfs/dbraw/zinc/29/48/55/394294855.db2.gz BHLCINANRJMUDV-CYBMUJFWSA-N 2 0 289.379 2.864 20 5 CFBDRP C[C@H](N[C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000156581389 394335660 /nfs/dbraw/zinc/33/56/60/394335660.db2.gz NSWIAUXZTRSCDL-DYEKYZERSA-N 2 0 277.368 2.728 20 5 CFBDRP CC[NH2+]CC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000347006730 162580134 /nfs/dbraw/zinc/58/01/34/162580134.db2.gz CINWQZCATULMOM-UHFFFAOYSA-N 2 0 291.395 2.725 20 5 CFBDRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])[C@@H]2CCC[C@H]21 ZINC000353408729 163359791 /nfs/dbraw/zinc/35/97/91/163359791.db2.gz VAPGOPZNGMXGHH-OFQRWUPVSA-N 2 0 289.379 2.557 20 5 CFBDRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000044515978 175189931 /nfs/dbraw/zinc/18/99/31/175189931.db2.gz ZPKVFZNAFGEDCC-LBPRGKRZSA-N 2 0 277.368 2.587 20 5 CFBDRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccccc1[N+](=O)[O-] ZINC000044515213 175190056 /nfs/dbraw/zinc/19/00/56/175190056.db2.gz CVRAZZLIKRDKOT-LBPRGKRZSA-N 2 0 277.368 2.587 20 5 CFBDRP CC[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000423389003 288088824 /nfs/dbraw/zinc/08/88/24/288088824.db2.gz NXEOQLBGQSFBKO-IPYPFGDCSA-N 2 0 277.368 2.905 20 5 CFBDRP C[C@H](C[NH3+])C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000423308908 279289490 /nfs/dbraw/zinc/28/94/90/279289490.db2.gz PFIMICFQZWZIFM-QMTHXVAHSA-N 2 0 277.368 2.502 20 5 CFBDRP Cc1c(C[N@@H+]2CCCC[C@@H]2CC[NH3+])cccc1[N+](=O)[O-] ZINC000070149476 280225450 /nfs/dbraw/zinc/22/54/50/280225450.db2.gz JBXDERMQLQNNBT-CQSZACIVSA-N 2 0 277.368 2.607 20 5 CFBDRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000387310171 324490132 /nfs/dbraw/zinc/49/01/32/324490132.db2.gz LABNJSQATVCBNM-UHFFFAOYSA-N 2 0 285.413 2.866 20 5 CFBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CC1CC[NH2+]CC1)CCC2 ZINC000580541142 325044103 /nfs/dbraw/zinc/04/41/03/325044103.db2.gz CBAZFHIERLJCGU-MRXNPFEDSA-N 2 0 289.379 2.561 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+]C[C@]2(C)CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000423332184 534225807 /nfs/dbraw/zinc/22/58/07/534225807.db2.gz PBRGXDLFFUQGLM-XJKSGUPXSA-N 2 0 291.395 2.944 20 5 CFBDRP O=[N+]([O-])c1cccc(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)c1 ZINC000063197925 527386785 /nfs/dbraw/zinc/38/67/85/527386785.db2.gz CUWRROLBQDLSSN-MRXNPFEDSA-N 2 0 289.379 2.559 20 5 CFBDRP CC1(C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])CC[NH2+]CC1 ZINC000414909352 527980212 /nfs/dbraw/zinc/98/02/12/527980212.db2.gz RPSGEUUCZOUJNY-XQRVVYSFSA-N 2 0 289.379 2.587 20 5 CFBDRP CC(C)c1ccc(C[NH2+][C@@H](C)CC[NH3+])cc1[N+](=O)[O-] ZINC000414890126 528099823 /nfs/dbraw/zinc/09/98/23/528099823.db2.gz TYGKLLAIWMWJIX-NSHDSACASA-N 2 0 265.357 2.545 20 5 CFBDRP CCC[C@H]([NH2+]CC[C@H](C)[NH3+])c1cccc([N+](=O)[O-])c1 ZINC000423224844 528220840 /nfs/dbraw/zinc/22/08/40/528220840.db2.gz CWGFEVHWHYHFMC-FZMZJTMJSA-N 2 0 265.357 2.763 20 5 CFBDRP CCC[C@H]([NH2+]C[C@@H](C)C[NH3+])c1cccc([N+](=O)[O-])c1 ZINC000423297306 528222668 /nfs/dbraw/zinc/22/26/68/528222668.db2.gz JRRVWQHXMZUHIA-FZMZJTMJSA-N 2 0 265.357 2.620 20 5 CFBDRP CCC[C@@H]([NH2+]C[C@@H](C)C[NH3+])c1cccc([N+](=O)[O-])c1 ZINC000423297308 529009522 /nfs/dbraw/zinc/00/95/22/529009522.db2.gz JRRVWQHXMZUHIA-SMDDNHRTSA-N 2 0 265.357 2.620 20 5 CFBDRP [NH3+]CCN(CCO)Cc1c2ccccc2cc2ccccc21 ZINC000841059549 620423655 /nfs/dbraw/zinc/42/36/55/620423655.db2.gz UJNMASODNIHHJP-UHFFFAOYSA-N 2 0 294.398 2.746 20 5 CFBDRP CC1(C)C[C@@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)c2cc([N+](=O)[O-])ccc21 ZINC000902483729 621110502 /nfs/dbraw/zinc/11/05/02/621110502.db2.gz AJCCSDVTRFDDFD-UEKVPHQBSA-N 2 0 289.379 2.644 20 5 CFBDRP C[C@@H]([NH2+]C[C@H]1CC[NH2+][C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000903987541 621499616 /nfs/dbraw/zinc/49/96/16/621499616.db2.gz GJCJZAANJZVCRM-UPJWGTAASA-N 2 0 277.368 2.634 20 5 CFBDRP C[C@H]([NH2+]C[C@@H]1CC[NH2+][C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000903987445 621499738 /nfs/dbraw/zinc/49/97/38/621499738.db2.gz GJCJZAANJZVCRM-RWMBFGLXSA-N 2 0 277.368 2.634 20 5 CFBDRP C[C@H](CCCC[NH3+])[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000841079406 621510418 /nfs/dbraw/zinc/51/04/18/621510418.db2.gz LZSOAKLGDKVXTK-SNVBAGLBSA-N 2 0 285.775 2.855 20 5 CFBDRP C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC[C@H]1C[NH3+] ZINC000904411997 621593296 /nfs/dbraw/zinc/59/32/96/621593296.db2.gz YUXCITHDBUVPSA-PWSUYJOCSA-N 2 0 297.786 2.665 20 5 CFBDRP C[C@@H]1C[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC[C@H]1C[NH3+] ZINC000923496424 626476420 /nfs/dbraw/zinc/47/64/20/626476420.db2.gz IDZHDERHMCPFTB-MNOVXSKESA-N 2 0 297.786 2.665 20 5 CFBDRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)C1 ZINC000873015634 641985423 /nfs/dbraw/zinc/98/54/23/641985423.db2.gz RKRQVRWOSQBXGU-AWEZNQCLSA-N 2 0 291.395 2.643 20 5 CFBDRP C[C@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])C1CC[NH2+]CC1 ZINC000873222394 642075205 /nfs/dbraw/zinc/07/52/05/642075205.db2.gz QKOQOXFUTUTHBX-BPJJOFIESA-N 2 0 289.379 2.586 20 5 CFBDRP Cc1ccc(C[NH2+][C@@H]2C[C@H]([NH3+])CC(C)(C)C2)cc1[N+](=O)[O-] ZINC000925735822 648303579 /nfs/dbraw/zinc/30/35/79/648303579.db2.gz YBZYBLYUDCUIHJ-UONOGXRCSA-N 2 0 291.395 2.899 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1([NH3+])CCCC1 ZINC000594739281 349485630 /nfs/dbraw/zinc/48/56/30/349485630.db2.gz SGLUILBZURKKDB-CYBMUJFWSA-N 2 0 291.395 2.777 20 5 CFBDRP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCCC[NH+](C)C ZINC000595015451 349550348 /nfs/dbraw/zinc/55/03/48/349550348.db2.gz NGBIBAZEOGYZKQ-LBPRGKRZSA-N 2 0 295.383 2.596 20 5 CFBDRP C[NH2+]CCC[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000414863071 529971681 /nfs/dbraw/zinc/97/16/81/529971681.db2.gz WRRXCPKJQMLDGR-ZFWWWQNUSA-N 2 0 291.395 2.505 20 5 CFBDRP CC(C)[C@H]([NH3+])CC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000596651239 349968277 /nfs/dbraw/zinc/96/82/77/349968277.db2.gz CUHJASVOWKFZOB-BXUZGUMPSA-N 2 0 265.357 2.619 20 5 CFBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1 ZINC000314910533 348427755 /nfs/dbraw/zinc/42/77/55/348427755.db2.gz OIOADQLJIZPPLF-WWGRRREGSA-N 2 0 289.379 2.717 20 5 CFBDRP C[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H]1CC[NH3+] ZINC000404444376 348592008 /nfs/dbraw/zinc/59/20/08/348592008.db2.gz WJUJHJLWKXZCNN-DOMZBBRYSA-N 2 0 277.368 2.544 20 5 CFBDRP CC[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1cccc([N+](=O)[O-])c1 ZINC000591579272 349031948 /nfs/dbraw/zinc/03/19/48/349031948.db2.gz FMFNJARWDHPLTK-LSDHHAIUSA-N 2 0 289.379 2.778 20 5 CFBDRP C[NH2+]Cc1ccccc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000593315793 349245690 /nfs/dbraw/zinc/24/56/90/349245690.db2.gz FAPVKIXPYCJWNX-UHFFFAOYSA-N 2 0 285.347 2.604 20 5 CFBDRP C[C@H]([NH3+])C1CC[NH+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000110645193 186309232 /nfs/dbraw/zinc/30/92/32/186309232.db2.gz FTJAFYHORHYZIZ-RYUDHWBXSA-N 2 0 277.368 2.715 20 5 CFBDRP C[C@@H](C[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-])C[NH+](C)C ZINC000293815271 198783807 /nfs/dbraw/zinc/78/38/07/198783807.db2.gz VUAMZTCDTAWENB-KBPBESRZSA-N 2 0 293.411 2.703 20 5 CFBDRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000422915025 237341605 /nfs/dbraw/zinc/34/16/05/237341605.db2.gz AKXMFHOWFWTCFG-GDBMZVCRSA-N 2 0 291.395 2.635 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+][C@@H]2CCC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000422917117 237345010 /nfs/dbraw/zinc/34/50/10/237345010.db2.gz CMVBFJBYMQCWDA-TZMCWYRMSA-N 2 0 277.368 2.696 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000422920536 237349932 /nfs/dbraw/zinc/34/99/32/237349932.db2.gz MXXZNEKBAHRLOV-GUTXKFCHSA-N 2 0 291.395 2.942 20 5 CFBDRP Cc1c([C@H](C)[NH2+]C[C@H]2CCC[NH2+]C2)cccc1[N+](=O)[O-] ZINC000423211355 238280096 /nfs/dbraw/zinc/28/00/96/238280096.db2.gz KZCFVOHJEPHWGB-STQMWFEESA-N 2 0 277.368 2.553 20 5 CFBDRP C[C@@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1 ZINC000423265217 238319904 /nfs/dbraw/zinc/31/99/04/238319904.db2.gz ZRNXQRKASABJGF-OLZOCXBDSA-N 2 0 277.368 2.635 20 5 CFBDRP Cc1c([C@H](C)[NH2+]C[C@@]2(C)CCC[NH2+]C2)cccc1[N+](=O)[O-] ZINC000423346300 238395789 /nfs/dbraw/zinc/39/57/89/238395789.db2.gz ZSJZEHACFUJNJU-BBRMVZONSA-N 2 0 291.395 2.944 20 5 CFBDRP C[NH2+]CCC1CC[NH+](Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000070189635 374143833 /nfs/dbraw/zinc/14/38/33/374143833.db2.gz XZAFKRCQANDTRW-UHFFFAOYSA-N 2 0 291.395 2.725 20 5 CFBDRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000135460092 378134053 /nfs/dbraw/zinc/13/40/53/378134053.db2.gz JRWOTZHMXOPUBW-CYBMUJFWSA-N 2 0 291.395 2.977 20 5 CFBDRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000135460074 378134314 /nfs/dbraw/zinc/13/43/14/378134314.db2.gz JRWOTZHMXOPUBW-ZDUSSCGKSA-N 2 0 291.395 2.977 20 5 CFBDRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000336817567 380680645 /nfs/dbraw/zinc/68/06/45/380680645.db2.gz QWIVQKQDLRLAHW-NEPJUHHUSA-N 2 0 265.357 2.763 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000414933563 381625089 /nfs/dbraw/zinc/62/50/89/381625089.db2.gz XAJPAJSCSNBKCV-YUELXQCFSA-N 2 0 291.395 2.775 20 5 CFBDRP O=[N+]([O-])c1ccc(C[NH2+]CCC[C@H]2CCC[NH2+]2)c(Cl)c1 ZINC000414980039 381674995 /nfs/dbraw/zinc/67/49/95/381674995.db2.gz WEIOZKTVBPVMCW-LBPRGKRZSA-N 2 0 297.786 2.870 20 5 CFBDRP Cc1ccc(C[NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)cc1[N+](=O)[O-] ZINC000414984861 381679350 /nfs/dbraw/zinc/67/93/50/381679350.db2.gz ATAIERZETNWZJQ-GXTWGEPZSA-N 2 0 277.368 2.510 20 5 CFBDRP O=[N+]([O-])c1ccc(C[NH2+]CCCCC[NH+]2CCCC2)cc1 ZINC000292900929 381894264 /nfs/dbraw/zinc/89/42/64/381894264.db2.gz DQGAWVZSAQNEKP-UHFFFAOYSA-N 2 0 291.395 2.951 20 5 CFBDRP CC(C)[N@H+](CC[C@H]1CC[NH2+]C1)Cc1ccc([N+](=O)[O-])cc1 ZINC000420297760 382348961 /nfs/dbraw/zinc/34/89/61/382348961.db2.gz DLQRSNURDCAYKR-CQSZACIVSA-N 2 0 291.395 2.805 20 5 CFBDRP [NH3+][C@@H]1CCC[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000577650210 382866748 /nfs/dbraw/zinc/86/67/48/382866748.db2.gz IDSFFUZRYOPVBU-OLZOCXBDSA-N 2 0 297.786 2.650 20 5 CFBDRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000423438658 383095655 /nfs/dbraw/zinc/09/56/55/383095655.db2.gz ROYVXBNNJBQXIW-CHWSQXEVSA-N 2 0 279.384 2.633 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)cc1[N+](=O)[O-] ZINC000423489762 383118406 /nfs/dbraw/zinc/11/84/06/383118406.db2.gz GPVLNMIQOYWNLE-OUCADQQQSA-N 2 0 277.368 2.681 20 5 CFBDRP Cc1ccc(C[NH2+]CCCC[N@@H+](C)C2CC2)cc1[N+](=O)[O-] ZINC000453600197 383869145 /nfs/dbraw/zinc/86/91/45/383869145.db2.gz RWJBRCPBCCACOA-UHFFFAOYSA-N 2 0 291.395 2.867 20 5 CFBDRP CN(CCC[NH+]1CCCC1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000282359798 385292649 /nfs/dbraw/zinc/29/26/49/385292649.db2.gz BFUITRQDTBULEK-UHFFFAOYSA-N 2 0 295.358 2.652 20 5 CFBDRP CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCC[NH2+]C1 ZINC000226437023 393770465 /nfs/dbraw/zinc/77/04/65/393770465.db2.gz ATOMJUFTZJMDDO-OAHLLOKOSA-N 2 0 291.395 2.805 20 5 CFBDRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)c1ccc([N+](=O)[O-])cc1 ZINC000051692817 287011695 /nfs/dbraw/zinc/01/16/95/287011695.db2.gz ABIWBKMSNBZRCQ-QFWMXSHPSA-N 2 0 263.341 2.515 20 5 CFBDRP C[C@H]([NH2+]C[C@@H]1CCC[C@H]([NH3+])C1)c1ccc([N+](=O)[O-])cc1 ZINC000423458399 274514033 /nfs/dbraw/zinc/51/40/33/274514033.db2.gz JTCDZATWRODERH-SCRDCRAPSA-N 2 0 277.368 2.763 20 5 CFBDRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000271914917 278341395 /nfs/dbraw/zinc/34/13/95/278341395.db2.gz YRTFHZYLJUOILO-GFCCVEGCSA-N 2 0 275.352 2.507 20 5 CFBDRP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000037648974 278351445 /nfs/dbraw/zinc/35/14/45/278351445.db2.gz WGFMZHYTQZWONB-OLZOCXBDSA-N 2 0 289.379 2.730 20 5 CFBDRP C[C@H]([NH2+][C@H]1CCCC[C@@H]1C[NH3+])c1cccc([N+](=O)[O-])c1 ZINC000089144935 279533684 /nfs/dbraw/zinc/53/36/84/279533684.db2.gz OYSSTFBOPKMFTB-LNSITVRQSA-N 2 0 277.368 2.763 20 5 CFBDRP C[C@H]([NH2+]C1CCC(C[NH3+])CC1)c1cccc([N+](=O)[O-])c1 ZINC000422950057 533803641 /nfs/dbraw/zinc/80/36/41/533803641.db2.gz VBTBPWYTKBLPBK-DCBWTQNWSA-N 2 0 277.368 2.763 20 5 CFBDRP Cc1ccc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)cc1[N+](=O)[O-] ZINC000414971019 534057092 /nfs/dbraw/zinc/05/70/92/534057092.db2.gz LAZMAJXCGNRWEL-CQSZACIVSA-N 2 0 277.368 2.525 20 5 CFBDRP [NH3+]CCCC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000414915282 534605907 /nfs/dbraw/zinc/60/59/07/534605907.db2.gz YWVKIPQWOBHQHN-UHFFFAOYSA-N 2 0 289.335 2.683 20 5 CFBDRP C[NH+]1CCC(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000050443952 523764355 /nfs/dbraw/zinc/76/43/55/523764355.db2.gz LSSSDUVYEWVSEL-UHFFFAOYSA-N 2 0 297.786 2.680 20 5 CFBDRP CC1(C)C[C@@H]([NH3+])C[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C1 ZINC000925592919 618279769 /nfs/dbraw/zinc/27/97/69/618279769.db2.gz IAKDWOSQNZVPGC-QWHCGFSZSA-N 2 0 277.368 2.590 20 5 CFBDRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000895205263 618470040 /nfs/dbraw/zinc/47/00/40/618470040.db2.gz OQQYSKHFYLWFIE-GSJFWJNXSA-N 2 0 297.786 2.678 20 5 CFBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC[C@H](C)[NH+](C)C ZINC000895292252 618515069 /nfs/dbraw/zinc/51/50/69/618515069.db2.gz ALKHFBLGOQAYAZ-KBPBESRZSA-N 2 0 293.411 2.846 20 5 CFBDRP C[C@H]([NH2+]C[C@]12CCC[C@H]1[NH2+]CC2)c1cccc([N+](=O)[O-])c1 ZINC000925840004 619173709 /nfs/dbraw/zinc/17/37/09/619173709.db2.gz FLAVFGVHLJZENX-APHBMKBZSA-N 2 0 289.379 2.778 20 5 CFBDRP [NH3+][C@@H]1CC[C@H](C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)C1 ZINC000903454644 621388223 /nfs/dbraw/zinc/38/82/23/621388223.db2.gz GZNWDLOXIPMXRU-UONOGXRCSA-N 2 0 289.379 2.687 20 5 CFBDRP C[C@@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1ccc([N+](=O)[O-])cc1 ZINC000903987553 621499418 /nfs/dbraw/zinc/49/94/18/621499418.db2.gz GUICYSDYIZOIET-RTXFEEFZSA-N 2 0 263.341 2.515 20 5 CFBDRP C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)CC(C)(C)C[NH3+] ZINC000093861252 626328517 /nfs/dbraw/zinc/32/85/17/626328517.db2.gz FHUHEXOWOAAUFO-NSHDSACASA-N 2 0 265.357 2.573 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H](C[NH3+])[C@H](C)C1 ZINC000923494805 626476881 /nfs/dbraw/zinc/47/68/81/626476881.db2.gz OVTFLFZYAWQPHT-HZSPNIEDSA-N 2 0 291.395 2.881 20 5 CFBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](C[NH3+])[C@H](C)C1 ZINC000923498731 626477118 /nfs/dbraw/zinc/47/71/18/626477118.db2.gz JJJLHNZVKZBMHE-YRGRVCCFSA-N 2 0 277.368 2.573 20 5 CFBDRP C[C@H]1C[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CC[C@@H]1C[NH3+] ZINC000923499744 626477493 /nfs/dbraw/zinc/47/74/93/626477493.db2.gz SXNIDBYBPLCHAZ-WDEREUQCSA-N 2 0 297.786 2.665 20 5 CFBDRP C[N@H+]1CC=C(C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000783652447 628731074 /nfs/dbraw/zinc/73/10/74/628731074.db2.gz MNOHAZRNQWRFKI-UHFFFAOYSA-N 2 0 295.770 2.600 20 5 CFBDRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000841057102 631323437 /nfs/dbraw/zinc/32/34/37/631323437.db2.gz HYMMIUABERACRS-WDEREUQCSA-N 2 0 283.759 2.608 20 5 CFBDRP C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C1CC[NH2+]CC1 ZINC000873266363 642109088 /nfs/dbraw/zinc/10/90/88/642109088.db2.gz WFNOWAWZLVOKSA-NWDGAFQWSA-N 2 0 277.368 2.634 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@@H]([NH3+])C23CCC3)cc1[N+](=O)[O-] ZINC000925575918 648224624 /nfs/dbraw/zinc/22/46/24/648224624.db2.gz JANGULHTTMMWEG-NILFDRSVSA-N 2 0 289.379 2.824 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@H]2C[C@H]([NH3+])C23CCC3)cc1[N+](=O)[O-] ZINC000925575916 648224784 /nfs/dbraw/zinc/22/47/84/648224784.db2.gz JANGULHTTMMWEG-CQDKDKBSSA-N 2 0 289.379 2.824 20 5 CFBDRP Cc1c([C@H](C)[NH2+]CC2CC[NH+](C)CC2)cccc1[N+](=O)[O-] ZINC000126282839 187229865 /nfs/dbraw/zinc/22/98/65/187229865.db2.gz ZDRCHXPIDJNQIR-ZDUSSCGKSA-N 2 0 291.395 2.896 20 5 CFBDRP C[NH2+]C[C@H](C)CNc1cc(C)[nH+]c2ccc([N+](=O)[O-])cc12 ZINC000122235591 529999965 /nfs/dbraw/zinc/99/99/65/529999965.db2.gz JWDWFXVEWABCII-JTQLQIEISA-N 2 0 288.351 2.719 20 5 CFBDRP Cc1c(C[N@H+]2CCC[C@@H](C)[C@H]2CC[NH3+])cccc1[N+](=O)[O-] ZINC000404382703 348591414 /nfs/dbraw/zinc/59/14/14/348591414.db2.gz NCMZXYMDCYCQBX-IUODEOHRSA-N 2 0 291.395 2.853 20 5 CFBDRP CC(C)c1ccc(C[NH2+][C@@H]2CCC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000591278585 349006350 /nfs/dbraw/zinc/00/63/50/349006350.db2.gz UDPYAUMVAMWGAG-CQSZACIVSA-N 2 0 291.395 2.950 20 5 CFBDRP CC[NH2+]CCC[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000591577175 349031128 /nfs/dbraw/zinc/03/11/28/349031128.db2.gz WFHWCRWBOVWNMA-HNNXBMFYSA-N 2 0 291.395 2.505 20 5 CFBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@@H]1CCC[NH2+]CC1)CCC2 ZINC000591578352 349032164 /nfs/dbraw/zinc/03/21/64/349032164.db2.gz VQQMGEPITTZOQX-CJNGLKHVSA-N 2 0 289.379 2.704 20 5 CFBDRP C[C@H]1CC2(C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1)CC[NH2+]CC2 ZINC000591658943 349037465 /nfs/dbraw/zinc/03/74/65/349037465.db2.gz YJYVKMLNFIIUGF-ZDUSSCGKSA-N 2 0 289.379 2.559 20 5 CFBDRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccccc1[N+](=O)[O-] ZINC000592471107 349126250 /nfs/dbraw/zinc/12/62/50/349126250.db2.gz YITYBBZAQICSAM-REWJHTLYSA-N 2 0 289.379 2.634 20 5 CFBDRP Cc1ccc(C[N@H+]2CCC[C@H](C)[C@H]2CC[NH3+])cc1[N+](=O)[O-] ZINC000593317799 349246384 /nfs/dbraw/zinc/24/63/84/349246384.db2.gz YOYINBVHOVRYFV-SWLSCSKDSA-N 2 0 291.395 2.853 20 5 CFBDRP CCN(CC[NH3+])Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000600777600 350609402 /nfs/dbraw/zinc/60/94/02/350609402.db2.gz VFBQWQNLKPPPNS-UHFFFAOYSA-N 2 0 289.335 2.635 20 5 CFBDRP C[C@H]([NH3+])C1CC[NH+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000110644344 186308678 /nfs/dbraw/zinc/30/86/78/186308678.db2.gz NDKRYGWRFOCPKP-RYUDHWBXSA-N 2 0 277.368 2.715 20 5 CFBDRP C[C@@H]([NH3+])C1CC[NH+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000110645188 186308883 /nfs/dbraw/zinc/30/88/83/186308883.db2.gz FTJAFYHORHYZIZ-NEPJUHHUSA-N 2 0 277.368 2.715 20 5 CFBDRP Cc1ccc(C[NH2+][C@H]2CC[NH2+]CC(C)(C)C2)cc1[N+](=O)[O-] ZINC000601973628 350822451 /nfs/dbraw/zinc/82/24/51/350822451.db2.gz SBHXGJUUBRCXDS-AWEZNQCLSA-N 2 0 291.395 2.771 20 5 CFBDRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000423016569 295852345 /nfs/dbraw/zinc/85/23/45/295852345.db2.gz MYALXPQGSSRLGQ-RYUDHWBXSA-N 2 0 265.357 2.763 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+][C@H]2CCC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000422917116 237344507 /nfs/dbraw/zinc/34/45/07/237344507.db2.gz CMVBFJBYMQCWDA-OCCSQVGLSA-N 2 0 277.368 2.696 20 5 CFBDRP Cc1c([C@H](C)[NH2+]C[C@@H]2CCC[NH2+]C2)cccc1[N+](=O)[O-] ZINC000423211353 238280583 /nfs/dbraw/zinc/28/05/83/238280583.db2.gz KZCFVOHJEPHWGB-QWHCGFSZSA-N 2 0 277.368 2.553 20 5 CFBDRP C[NH+](C)CCCC[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000049963843 373338512 /nfs/dbraw/zinc/33/85/12/373338512.db2.gz CXSJRPSVDSFIQT-UHFFFAOYSA-N 2 0 285.775 2.680 20 5 CFBDRP C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000358507700 380892457 /nfs/dbraw/zinc/89/24/57/380892457.db2.gz LCPOOKURUNEXPW-ZDUSSCGKSA-N 2 0 289.379 2.731 20 5 CFBDRP [NH3+]C[C@H]1CC[C@H](C[NH2+]Cc2csc([N+](=O)[O-])c2)CC1 ZINC000415019261 381713409 /nfs/dbraw/zinc/71/34/09/381713409.db2.gz DRSBLJPANCLQAX-XYPYZODXSA-N 2 0 283.397 2.511 20 5 CFBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CC[C@H]1CCC[NH2+]1)CCC2 ZINC000423355094 383062658 /nfs/dbraw/zinc/06/26/58/383062658.db2.gz DVEIJQAKIZAYRD-CJNGLKHVSA-N 2 0 289.379 2.704 20 5 CFBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(C[NH+](C)C)CC1 ZINC000488396302 383529104 /nfs/dbraw/zinc/52/91/04/383529104.db2.gz JJTOIQFJEODVJW-ZDUSSCGKSA-N 2 0 291.395 2.929 20 5 CFBDRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1ccc([N+](=O)[O-])cc1 ZINC000423372128 394279079 /nfs/dbraw/zinc/27/90/79/394279079.db2.gz GUICYSDYIZOIET-WCFLWFBJSA-N 2 0 263.341 2.515 20 5 CFBDRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)[C@@H]2CCC[C@H]21 ZINC000375801580 157285938 /nfs/dbraw/zinc/28/59/38/157285938.db2.gz LYOURIGMBOJKPL-HRCADAONSA-N 2 0 289.379 2.557 20 5 CFBDRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000125435423 274512257 /nfs/dbraw/zinc/51/22/57/274512257.db2.gz APHSYRKBZPTXRN-ZDUSSCGKSA-N 2 0 291.395 2.977 20 5 CFBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)CCC2 ZINC000423247046 275038308 /nfs/dbraw/zinc/03/83/08/275038308.db2.gz KOBHCRZSKBWEPO-MLGOLLRUSA-N 2 0 289.379 2.561 20 5 CFBDRP C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C[NH3+])c1cccc([N+](=O)[O-])c1 ZINC000089144931 290004805 /nfs/dbraw/zinc/00/48/05/290004805.db2.gz OYSSTFBOPKMFTB-NJZAAPMLSA-N 2 0 277.368 2.763 20 5 CFBDRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1ccc([N+](=O)[O-])cc1 ZINC000423372123 290008927 /nfs/dbraw/zinc/00/89/27/290008927.db2.gz GUICYSDYIZOIET-CYZMBNFOSA-N 2 0 263.341 2.515 20 5 CFBDRP C[C@H](CCC[NH3+])[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000415017461 533872283 /nfs/dbraw/zinc/87/22/83/533872283.db2.gz FODVMBKSGROBQF-OLZOCXBDSA-N 2 0 279.384 2.633 20 5 CFBDRP Cc1c([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[NH2+]C2)cccc1[N+](=O)[O-] ZINC000423221838 533956830 /nfs/dbraw/zinc/95/68/30/533956830.db2.gz YJRCWXQZIJTSAT-HZSPNIEDSA-N 2 0 291.395 2.942 20 5 CFBDRP [NH3+]CCCC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000414897801 534605289 /nfs/dbraw/zinc/60/52/89/534605289.db2.gz CXQKYMKHTSWDRT-UHFFFAOYSA-N 2 0 289.335 2.683 20 5 CFBDRP CC(C)([NH3+])C[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000414808843 527256940 /nfs/dbraw/zinc/25/69/40/527256940.db2.gz UKBYYCGQQTWFRQ-TZMCWYRMSA-N 2 0 291.395 2.633 20 5 CFBDRP CC[C@@H]([NH2+][C@H](C)CCC[NH3+])c1cccc([N+](=O)[O-])c1 ZINC000422838994 529204882 /nfs/dbraw/zinc/20/48/82/529204882.db2.gz PKJKISYAYZYGBQ-BXUZGUMPSA-N 2 0 265.357 2.763 20 5 CFBDRP CC1(C)C[C@@H]([NH3+])C[C@@H]([NH2+]CCc2ccccc2[N+](=O)[O-])C1 ZINC000925517273 618855648 /nfs/dbraw/zinc/85/56/48/618855648.db2.gz ZSKKSNXBHUGJMF-UONOGXRCSA-N 2 0 291.395 2.633 20 5 CFBDRP C[C@H]([NH2+]C[C@]12CCC[C@H]1[NH2+]CC2)c1ccc([N+](=O)[O-])cc1 ZINC000925839285 619172229 /nfs/dbraw/zinc/17/22/29/619172229.db2.gz BRDRFNGPHDBJHB-APHBMKBZSA-N 2 0 289.379 2.778 20 5 CFBDRP [NH3+]CC[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000093633678 619279620 /nfs/dbraw/zinc/27/96/20/619279620.db2.gz NXDUCHVQNYJEGX-NSHDSACASA-N 2 0 297.786 2.809 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[C@H]([NH3+])C2)cc1[N+](=O)[O-] ZINC000903458971 621380836 /nfs/dbraw/zinc/38/08/36/621380836.db2.gz OPMKDZZPKWORBZ-BZPMIXESSA-N 2 0 277.368 2.681 20 5 CFBDRP C[C@@H]([NH2+]C[C@@H]1CC[NH2+][C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000903987543 621499475 /nfs/dbraw/zinc/49/94/75/621499475.db2.gz GJCJZAANJZVCRM-YNEHKIRRSA-N 2 0 277.368 2.634 20 5 CFBDRP C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC[C@H]1C[NH3+] ZINC000904411585 621592848 /nfs/dbraw/zinc/59/28/48/621592848.db2.gz NTKRBWHJMUWSJR-MNOVXSKESA-N 2 0 297.786 2.665 20 5 CFBDRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000848923587 633405720 /nfs/dbraw/zinc/40/57/20/633405720.db2.gz NWDHXWPFSNNASP-TXEJJXNPSA-N 2 0 297.786 2.678 20 5 CFBDRP C[C@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccc([N+](=O)[O-])c1 ZINC000873259924 642104156 /nfs/dbraw/zinc/10/41/56/642104156.db2.gz OQKWRVKKGXAFHB-VIRABCJISA-N 2 0 289.379 2.776 20 5 CFBDRP C[NH+](C)CC1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000094774602 650963238 /nfs/dbraw/zinc/96/32/38/650963238.db2.gz DLSVRMJDKJJJCV-UHFFFAOYSA-N 2 0 295.358 2.508 20 5 CFBDRP C[C@H]([NH2+][C@H]1C[C@H]([NH3+])C12CCC2)c1ccc([N+](=O)[O-])cc1 ZINC000925675227 648274044 /nfs/dbraw/zinc/27/40/44/648274044.db2.gz MKNFFIOTRSWFKC-BPNCWPANSA-N 2 0 275.352 2.515 20 5 CFBDRP CC[C@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000925797982 648326791 /nfs/dbraw/zinc/32/67/91/648326791.db2.gz JBVSWEHORQSQRS-XPKDYRNWSA-N 2 0 291.395 2.881 20 5 CFBDRP C[C@H](C[N+](C)(C)C)O[C@@H](CC[NH+](C)C)c1ccccc1 ZINC001224133276 775107849 /nfs/dbraw/zinc/10/78/49/775107849.db2.gz KNYXFJAFUPYSDL-WBVHZDCISA-N 2 0 279.448 2.791 20 5 CFBDRP [NH3+]CCN(CC[NH3+])Cc1c2ccccc2cc2ccccc21 ZINC001235878288 778587368 /nfs/dbraw/zinc/58/73/68/778587368.db2.gz XFDPBJWOZUVZPH-UHFFFAOYSA-N 2 0 293.414 2.712 20 5 CFBDRP C[NH2+]C[C@@H](C)C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000423275178 529986064 /nfs/dbraw/zinc/98/60/64/529986064.db2.gz MTRXLBSXCMWVIR-IAQYHMDHSA-N 2 0 291.395 2.762 20 5 CFBDRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000596651240 349968946 /nfs/dbraw/zinc/96/89/46/349968946.db2.gz CUHJASVOWKFZOB-SMDDNHRTSA-N 2 0 265.357 2.619 20 5 CFBDRP CC[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2Cl)CC[C@@H]1[NH3+] ZINC000122781936 347817286 /nfs/dbraw/zinc/81/72/86/347817286.db2.gz PBJNBIVUXXVFPK-YGRLFVJLSA-N 2 0 297.786 2.807 20 5 CFBDRP Cc1c(C[NH2+][C@@H](C)C2CC[NH+](C)CC2)cccc1[N+](=O)[O-] ZINC000231883779 348208916 /nfs/dbraw/zinc/20/89/16/348208916.db2.gz KIZSLQCDVYFEQS-ZDUSSCGKSA-N 2 0 291.395 2.723 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+][C@H]2CC23CC[NH2+]CC3)cc1[N+](=O)[O-] ZINC000591579297 349032274 /nfs/dbraw/zinc/03/22/74/349032274.db2.gz HXDNNVMPJJVUOF-DOMZBBRYSA-N 2 0 289.379 2.696 20 5 CFBDRP C[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000593322417 349247238 /nfs/dbraw/zinc/24/72/38/349247238.db2.gz MVYGREZEDPSKEP-GFCCVEGCSA-N 2 0 277.368 2.635 20 5 CFBDRP CC(C)(C)[NH2+]CCNc1ccc2cnccc2c1[N+](=O)[O-] ZINC000599038379 350362632 /nfs/dbraw/zinc/36/26/32/350362632.db2.gz POEPPYZGVKHGGQ-UHFFFAOYSA-N 2 0 288.351 2.943 20 5 CFBDRP C[C@H](NC[C@@H]1CCCC[N@H+](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000599070032 350370307 /nfs/dbraw/zinc/37/03/07/350370307.db2.gz JOZKRORIJBJQFN-KBPBESRZSA-N 2 0 291.395 2.977 20 5 CFBDRP C[C@@H]([NH3+])C1CC[NH+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000110644341 186308691 /nfs/dbraw/zinc/30/86/91/186308691.db2.gz NDKRYGWRFOCPKP-VXGBXAGGSA-N 2 0 277.368 2.715 20 5 CFBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC([C@H](C)[NH3+])CC1 ZINC000110644346 186309216 /nfs/dbraw/zinc/30/92/16/186309216.db2.gz NDKRYGWRFOCPKP-NWDGAFQWSA-N 2 0 277.368 2.715 20 5 CFBDRP C[C@@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1cccc([N+](=O)[O-])c1 ZINC000602022775 350834227 /nfs/dbraw/zinc/83/42/27/350834227.db2.gz VBTBPWYTKBLPBK-YRGRVCCFSA-N 2 0 277.368 2.763 20 5 CFBDRP [NH3+]C1CCC([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000332202369 283412876 /nfs/dbraw/zinc/41/28/76/283412876.db2.gz GIXGXCCGAFHSRM-SEEARECTSA-N 2 0 289.379 2.832 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@H](C)CCC[NH3+])cc1[N+](=O)[O-] ZINC000422917965 237344592 /nfs/dbraw/zinc/34/45/92/237344592.db2.gz GKUUFAWZGNGQEL-NEPJUHHUSA-N 2 0 265.357 2.681 20 5 CFBDRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1 ZINC000422949629 237377252 /nfs/dbraw/zinc/37/72/52/237377252.db2.gz UPZRVUZDZAPPMU-SGMGOOAPSA-N 2 0 277.368 2.634 20 5 CFBDRP Cc1c([C@H](C)N[C@H](C[NH3+])CC(C)C)cccc1[N+](=O)[O-] ZINC000423259003 238313975 /nfs/dbraw/zinc/31/39/75/238313975.db2.gz CVVVRWARNFLJRY-STQMWFEESA-N 2 0 279.384 2.927 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+]CC2(C)CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000423345298 238393291 /nfs/dbraw/zinc/39/32/91/238393291.db2.gz YPYDEMLLHUTDII-ZDUSSCGKSA-N 2 0 291.395 2.944 20 5 CFBDRP [NH3+]C1CCC([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000332202371 378736229 /nfs/dbraw/zinc/73/62/29/378736229.db2.gz GIXGXCCGAFHSRM-ZUEPYMLJSA-N 2 0 289.379 2.832 20 5 CFBDRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)C1 ZINC000163262488 378962807 /nfs/dbraw/zinc/96/28/07/378962807.db2.gz RFWFKGHLCYYWFV-UONOGXRCSA-N 2 0 291.395 2.896 20 5 CFBDRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000400997261 380866557 /nfs/dbraw/zinc/86/65/57/380866557.db2.gz JIPZGDSXZNGQNL-PMOUVXMZSA-N 2 0 289.379 2.634 20 5 CFBDRP C[C@@H]([NH3+])C1CC[NH+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000347183470 380989908 /nfs/dbraw/zinc/98/99/08/380989908.db2.gz XHBXSHCNBBNIBW-DIECRNLCSA-N 2 0 289.379 2.667 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000414954936 381647051 /nfs/dbraw/zinc/64/70/51/381647051.db2.gz SYIGFRJMAAOXCK-UMVBOHGHSA-N 2 0 291.395 2.646 20 5 CFBDRP Cc1ccc(C[NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)cc1[N+](=O)[O-] ZINC000414984865 381679100 /nfs/dbraw/zinc/67/91/00/381679100.db2.gz ATAIERZETNWZJQ-OCCSQVGLSA-N 2 0 277.368 2.510 20 5 CFBDRP CC[C@H]([NH3+])C[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000414994738 381687134 /nfs/dbraw/zinc/68/71/34/381687134.db2.gz VESOBVAONWEIOB-QEJZJMRPSA-N 2 0 291.395 2.633 20 5 CFBDRP [NH3+][C@H]1CCC[C@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000414995490 381687582 /nfs/dbraw/zinc/68/75/82/381687582.db2.gz FTPBRWHZEWHHMY-JQWIXIFHSA-N 2 0 297.786 2.855 20 5 CFBDRP CC1(C)C[C@@H]([NH2+]CCCC[NH3+])c2cc([N+](=O)[O-])ccc21 ZINC000423343436 383059312 /nfs/dbraw/zinc/05/93/12/383059312.db2.gz ZUELBVVJTYILST-CQSZACIVSA-N 2 0 277.368 2.646 20 5 CFBDRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000423037371 383023900 /nfs/dbraw/zinc/02/39/00/383023900.db2.gz BHDDTCKLOMAJKR-AAEUAGOBSA-N 2 0 297.786 2.508 20 5 CFBDRP C[C@@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)c1ccc([N+](=O)[O-])cc1 ZINC000423427559 383092786 /nfs/dbraw/zinc/09/27/86/383092786.db2.gz FXPGDGOBCDHJAK-XFBWCDHKSA-N 2 0 289.379 2.634 20 5 CFBDRP C[C@H]([NH2+]C[C@H]1CCC[C@@H]([NH3+])C1)c1ccc([N+](=O)[O-])cc1 ZINC000423458401 383102718 /nfs/dbraw/zinc/10/27/18/383102718.db2.gz JTCDZATWRODERH-SGMGOOAPSA-N 2 0 277.368 2.763 20 5 CFBDRP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cccc([N+](=O)[O-])c1 ZINC000423479635 383112698 /nfs/dbraw/zinc/11/26/98/383112698.db2.gz MIFAAYYDDCEWAM-JSGCOSHPSA-N 2 0 277.368 2.778 20 5 CFBDRP C[NH+](C)CCCC[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000572984361 383853344 /nfs/dbraw/zinc/85/33/44/383853344.db2.gz AWMRFQCFKBERQR-CQSZACIVSA-N 2 0 277.368 2.514 20 5 CFBDRP CC(C)[N@H+](C)CCCN[C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000574583740 384117867 /nfs/dbraw/zinc/11/78/67/384117867.db2.gz NEXBUNYDAZNCAK-HNNXBMFYSA-N 2 0 291.395 2.902 20 5 CFBDRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)[C@H]2CCC[C@@H]21 ZINC000375801583 157286125 /nfs/dbraw/zinc/28/61/25/157286125.db2.gz LYOURIGMBOJKPL-PMPSAXMXSA-N 2 0 289.379 2.557 20 5 CFBDRP C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@H]1CCC[NH2+]C1 ZINC000423218621 287051334 /nfs/dbraw/zinc/05/13/34/287051334.db2.gz SCVZWSGULLVIBF-SCRDCRAPSA-N 2 0 277.368 2.634 20 5 CFBDRP C[C@H](C[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-])C[NH+](C)C ZINC000293815276 279351325 /nfs/dbraw/zinc/35/13/25/279351325.db2.gz VUAMZTCDTAWENB-ZIAGYGMSSA-N 2 0 293.411 2.703 20 5 CFBDRP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000414804994 279422724 /nfs/dbraw/zinc/42/27/24/279422724.db2.gz FYSJCXYPLIDFEB-LBPRGKRZSA-N 2 0 285.347 2.904 20 5 CFBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](CC[NH3+])C1 ZINC000070169445 290251619 /nfs/dbraw/zinc/25/16/19/290251619.db2.gz CKCNDLFOCSCTKZ-CHWSQXEVSA-N 2 0 277.368 2.717 20 5 CFBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@@H]2C1 ZINC000228476476 290267577 /nfs/dbraw/zinc/26/75/77/290267577.db2.gz BMEZGTGZQZLEAC-AYRXBEOTSA-N 2 0 289.379 2.715 20 5 CFBDRP [NH3+]CCCC[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000414915298 295229066 /nfs/dbraw/zinc/22/90/66/295229066.db2.gz YYAJKZYXSGNNDU-HIFRSBDPSA-N 2 0 291.395 2.635 20 5 CFBDRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000163261940 322374643 /nfs/dbraw/zinc/37/46/43/322374643.db2.gz WIFGKLLJUUZTRC-UONOGXRCSA-N 2 0 291.395 2.896 20 5 CFBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH2+]CC1)CCC2 ZINC000580541141 325044247 /nfs/dbraw/zinc/04/42/47/325044247.db2.gz CBAZFHIERLJCGU-INIZCTEOSA-N 2 0 289.379 2.561 20 5 CFBDRP C[C@]1(C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])CCC[NH2+]C1 ZINC000414913813 534175899 /nfs/dbraw/zinc/17/58/99/534175899.db2.gz WYBLLWGKGXWVNY-IEXSPKMKSA-N 2 0 289.379 2.587 20 5 CFBDRP C[NH+](C)CCCC[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000050444036 524052877 /nfs/dbraw/zinc/05/28/77/524052877.db2.gz BDHKSLQUUZGCFI-UHFFFAOYSA-N 2 0 285.775 2.680 20 5 CFBDRP CC[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000423349847 529158209 /nfs/dbraw/zinc/15/82/09/529158209.db2.gz XWPHPKKUQLKSHN-OAHLLOKOSA-N 2 0 275.352 2.555 20 5 CFBDRP CC1(C)C[C@@H]([NH3+])C[C@@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C1 ZINC000925628377 618355955 /nfs/dbraw/zinc/35/59/55/618355955.db2.gz DWYDCHXVPOEDJY-UONOGXRCSA-N 2 0 291.395 2.633 20 5 CFBDRP C[NH2+]CCC1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000070190014 625280214 /nfs/dbraw/zinc/28/02/14/625280214.db2.gz QZLZSZUCISSSGG-UHFFFAOYSA-N 2 0 295.358 2.555 20 5 CFBDRP CC1(C)C[NH2+]CC[C@H]([NH2+]CCc2ccccc2[N+](=O)[O-])C1 ZINC000902332154 621039053 /nfs/dbraw/zinc/03/90/53/621039053.db2.gz CUADVMHZMBIASI-AWEZNQCLSA-N 2 0 291.395 2.505 20 5 CFBDRP CC1(C)C[NH2+]CC[C@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C1 ZINC000902366995 621042884 /nfs/dbraw/zinc/04/28/84/621042884.db2.gz BYYZYHLHFGSTMZ-AWEZNQCLSA-N 2 0 291.395 2.505 20 5 CFBDRP C[C@H](C[NH2+][C@@H]1CCCCC[C@H]1[NH3+])c1ccccc1[N+](=O)[O-] ZINC000902430068 621076445 /nfs/dbraw/zinc/07/64/45/621076445.db2.gz OAXLHTRSNKDHGR-BPLDGKMQSA-N 2 0 291.395 2.948 20 5 CFBDRP C[C@H](C[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C)c1ccccc1[N+](=O)[O-] ZINC000902432066 621077491 /nfs/dbraw/zinc/07/74/91/621077491.db2.gz UUKQFUFDQOHFIY-GZBFAFLISA-N 2 0 291.395 2.676 20 5 CFBDRP C[C@H](C[NH2+][C@H]1C[C@H]([NH3+])C12CCC2)c1ccccc1[N+](=O)[O-] ZINC000902431627 621077881 /nfs/dbraw/zinc/07/78/81/621077881.db2.gz SZXXWKIYJKSQHP-UGFHNGPFSA-N 2 0 289.379 2.558 20 5 CFBDRP C[N@H+](CC[C@H]1CC[NH2+]C1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000842471750 631639562 /nfs/dbraw/zinc/63/95/62/631639562.db2.gz XDWHILKCTKPDFL-LLVKDONJSA-N 2 0 297.786 2.680 20 5 CFBDRP C[C@H]([NH2+]CCCCCC[NH3+])c1cccc([N+](=O)[O-])c1 ZINC000843342383 631932311 /nfs/dbraw/zinc/93/23/11/631932311.db2.gz LVOBOVPFBHDPCI-LBPRGKRZSA-N 2 0 265.357 2.765 20 5 CFBDRP [NH3+]CCC1CC[NH+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000844911123 632333627 /nfs/dbraw/zinc/33/36/27/632333627.db2.gz KUHFJPOWNKCLAB-UHFFFAOYSA-N 2 0 297.786 2.809 20 5 CFBDRP C[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cccc([N+](=O)[O-])c1 ZINC000817946912 632749106 /nfs/dbraw/zinc/74/91/06/632749106.db2.gz HSRMMYLQQZRNOZ-ZDUSSCGKSA-N 2 0 299.374 2.947 20 5 CFBDRP Cc1c(CN[C@H]2CCC[C@H]([NH+](C)C)C2)cccc1[N+](=O)[O-] ZINC000873069558 642003294 /nfs/dbraw/zinc/00/32/94/642003294.db2.gz JYYLJZBRNCRHDF-GJZGRUSLSA-N 2 0 291.395 2.866 20 5 CFBDRP Cc1c(C[NH2+]CC[C@H]2CCC[N@@H+](C)C2)cccc1[N+](=O)[O-] ZINC000873130251 642021888 /nfs/dbraw/zinc/02/18/88/642021888.db2.gz CFQZDWGINIWTQE-CQSZACIVSA-N 2 0 291.395 2.725 20 5 CFBDRP C[C@@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1ccccc1[N+](=O)[O-] ZINC000873297330 642127553 /nfs/dbraw/zinc/12/75/53/642127553.db2.gz WJVCEARTPRKKGH-UTUOFQBUSA-N 2 0 263.341 2.515 20 5 CFBDRP C[C@@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1ccccc1[N+](=O)[O-] ZINC000873297329 642127623 /nfs/dbraw/zinc/12/76/23/642127623.db2.gz WJVCEARTPRKKGH-IJLUTSLNSA-N 2 0 263.341 2.515 20 5 CFBDRP C[C@@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccccc1[N+](=O)[O-] ZINC000873297603 642128780 /nfs/dbraw/zinc/12/87/80/642128780.db2.gz YITYBBZAQICSAM-ZOBORPQBSA-N 2 0 289.379 2.634 20 5 CFBDRP Cc1c(C[NH2+][C@H]2C[C@@H]([NH3+])CC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000925659466 648267675 /nfs/dbraw/zinc/26/76/75/648267675.db2.gz VAUHCRJETYFPKX-KGLIPLIRSA-N 2 0 291.395 2.899 20 5 CFBDRP Cc1ccc(C[NH2+][C@@H]2C[C@@H]([NH3+])CC(C)(C)C2)cc1[N+](=O)[O-] ZINC000925735824 648303122 /nfs/dbraw/zinc/30/31/22/648303122.db2.gz YBZYBLYUDCUIHJ-ZIAGYGMSSA-N 2 0 291.395 2.899 20 5 CFBDRP C[C@H](C[N+](C)(C)C)Oc1cccc([C@H](C)[NH+](C)C)c1 ZINC001229620786 776858213 /nfs/dbraw/zinc/85/82/13/776858213.db2.gz DLNJSVPWQSCCLP-KGLIPLIRSA-N 2 0 265.421 2.783 20 5 CFBDRP C[N@H+](CCCCCC[NH3+])Cc1ccccc1[N+](=O)[O-] ZINC000710821057 781340743 /nfs/dbraw/zinc/34/07/43/781340743.db2.gz YCWCQTVTUCRCDJ-UHFFFAOYSA-N 2 0 265.357 2.546 20 5 CFBDRP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCCC[NH+](C)C ZINC000595015450 349550417 /nfs/dbraw/zinc/55/04/17/349550417.db2.gz NGBIBAZEOGYZKQ-GFCCVEGCSA-N 2 0 295.383 2.596 20 5 CFBDRP C[C@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000037775678 346333645 /nfs/dbraw/zinc/33/36/45/346333645.db2.gz KIBUPWYWLHLJPI-STQMWFEESA-N 2 0 291.395 2.976 20 5 CFBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1 ZINC000314381684 348425728 /nfs/dbraw/zinc/42/57/28/348425728.db2.gz QZVBMXXDOGDIBR-INWMFGNUSA-N 2 0 289.379 2.717 20 5 CFBDRP C[C@@H]1CC2(C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1)CC[NH2+]CC2 ZINC000591658942 349037885 /nfs/dbraw/zinc/03/78/85/349037885.db2.gz YJYVKMLNFIIUGF-CYBMUJFWSA-N 2 0 289.379 2.559 20 5 CFBDRP Cc1ccc(C[N@H+]2CCC[C@@H](C)[C@H]2CC[NH3+])cc1[N+](=O)[O-] ZINC000593317798 349246647 /nfs/dbraw/zinc/24/66/47/349246647.db2.gz YOYINBVHOVRYFV-IUODEOHRSA-N 2 0 291.395 2.853 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000414794475 233353230 /nfs/dbraw/zinc/35/32/30/233353230.db2.gz FRZQUANUPMYPGE-WFASDCNBSA-N 2 0 277.368 2.510 20 5 CFBDRP C[C@@]1(C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])CCC[NH2+]C1 ZINC000414913815 233397590 /nfs/dbraw/zinc/39/75/90/233397590.db2.gz WYBLLWGKGXWVNY-RRGWEWPQSA-N 2 0 289.379 2.587 20 5 CFBDRP C[C@@H]([NH3+])C1CC[NH+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000110645191 186308657 /nfs/dbraw/zinc/30/86/57/186308657.db2.gz FTJAFYHORHYZIZ-VXGBXAGGSA-N 2 0 277.368 2.715 20 5 CFBDRP O=[N+]([O-])c1ccc(CC[NH2+]CCC[NH+]2CCCCC2)cc1 ZINC000602510162 350910216 /nfs/dbraw/zinc/91/02/16/350910216.db2.gz DKTXYIUKKLCYEQ-UHFFFAOYSA-N 2 0 291.395 2.603 20 5 CFBDRP Cc1c([C@H](C)N[C@@H](C[NH3+])CC(C)C)cccc1[N+](=O)[O-] ZINC000423259002 238313802 /nfs/dbraw/zinc/31/38/02/238313802.db2.gz CVVVRWARNFLJRY-QWHCGFSZSA-N 2 0 279.384 2.927 20 5 CFBDRP CC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@@H]1CCC[NH2+]CC1 ZINC000435379356 240306822 /nfs/dbraw/zinc/30/68/22/240306822.db2.gz BOAJANDLMOVTPC-OAHLLOKOSA-N 2 0 291.395 2.867 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+]CCCC[NH+](C)C)cc1[N+](=O)[O-] ZINC000045663758 373026548 /nfs/dbraw/zinc/02/65/48/373026548.db2.gz QWIMRZFZDLBOST-ZDUSSCGKSA-N 2 0 279.384 2.896 20 5 CFBDRP C[C@H]([NH2+]CCCC[NH+](C)C)c1ccc([N+](=O)[O-])cc1 ZINC000045663856 373027325 /nfs/dbraw/zinc/02/73/25/373027325.db2.gz WXXJCFCLRKGTDE-LBPRGKRZSA-N 2 0 265.357 2.587 20 5 CFBDRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000336817570 380680978 /nfs/dbraw/zinc/68/09/78/380680978.db2.gz QWIVQKQDLRLAHW-VXGBXAGGSA-N 2 0 265.357 2.763 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1CN[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000368318715 380989104 /nfs/dbraw/zinc/98/91/04/380989104.db2.gz NSFDMRABPKPEGP-GJZGRUSLSA-N 2 0 289.379 2.620 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1CN[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000368318711 380990118 /nfs/dbraw/zinc/99/01/18/380990118.db2.gz NSFDMRABPKPEGP-CABCVRRESA-N 2 0 289.379 2.620 20 5 CFBDRP Cc1ccc(C[NH2+][C@H](C)CCCC[NH3+])cc1[N+](=O)[O-] ZINC000415016002 381709871 /nfs/dbraw/zinc/70/98/71/381709871.db2.gz OSXVIWGXFYYEHL-GFCCVEGCSA-N 2 0 265.357 2.510 20 5 CFBDRP [NH3+][C@@H]1CCC[C@@H](C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000414986965 381681379 /nfs/dbraw/zinc/68/13/79/381681379.db2.gz CYTNQOVJQJVIBE-OTDCPUGPSA-N 2 0 289.379 2.715 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+]CC[C@@H]2CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000420413192 382403092 /nfs/dbraw/zinc/40/30/92/382403092.db2.gz SUKSLOVHDBACMD-KGLIPLIRSA-N 2 0 291.395 2.944 20 5 CFBDRP Cc1c([C@H](C)[NH2+][C@@H]2CC[C@H](C[NH3+])C2)cccc1[N+](=O)[O-] ZINC000423496393 383121382 /nfs/dbraw/zinc/12/13/82/383121382.db2.gz WTQHCQIEMJPNFS-RWMBFGLXSA-N 2 0 277.368 2.681 20 5 CFBDRP C[C@H]([NH2+]C[C@H]1CCC[C@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000423455967 383101737 /nfs/dbraw/zinc/10/17/37/383101737.db2.gz GHICSZPRPBHCBI-OBJOEFQTSA-N 2 0 277.368 2.763 20 5 CFBDRP CC[C@H]([NH3+])C[NH2+][C@@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000423458775 383103317 /nfs/dbraw/zinc/10/33/17/383103317.db2.gz HGPPUPOZHVDLBC-RYUDHWBXSA-N 2 0 297.424 2.792 20 5 CFBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC(C)(C)C[NH+](C)C ZINC000449064904 383157903 /nfs/dbraw/zinc/15/79/03/383157903.db2.gz WWOBZLJMBDSIDR-ZDUSSCGKSA-N 2 0 293.411 2.703 20 5 CFBDRP C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000431042076 383625355 /nfs/dbraw/zinc/62/53/55/383625355.db2.gz CIMYOVVMKJBQOZ-ZDUSSCGKSA-N 2 0 289.379 2.731 20 5 CFBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCCC[NH+](C)C ZINC000344827601 162129726 /nfs/dbraw/zinc/12/97/26/162129726.db2.gz BSURIZJNLUWCHQ-SDNWHVSQSA-N 2 0 291.395 2.930 20 5 CFBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCC[NH+](C)C ZINC000344860659 162134906 /nfs/dbraw/zinc/13/49/06/162134906.db2.gz PPIDPSWAPPHINU-JLHYYAGUSA-N 2 0 277.368 2.539 20 5 CFBDRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])[C@H]2CCC[C@@H]21 ZINC000353408730 163358473 /nfs/dbraw/zinc/35/84/73/163358473.db2.gz VAPGOPZNGMXGHH-YCPHGPKFSA-N 2 0 289.379 2.557 20 5 CFBDRP C[NH+]1CCC(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000044516297 175190636 /nfs/dbraw/zinc/19/06/36/175190636.db2.gz ZSZMLTMKUCDLRF-UHFFFAOYSA-N 2 0 297.786 2.680 20 5 CFBDRP [NH3+]CC[C@@H]1CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000442920082 227209452 /nfs/dbraw/zinc/20/94/52/227209452.db2.gz GJPDKECVIVANKO-GBXSZLQWSA-N 2 0 289.379 2.669 20 5 CFBDRP CC(C)c1ccc(C[NH2+][C@H]2CC[C@@H](C[NH3+])C2)cc1[N+](=O)[O-] ZINC000415047304 276053819 /nfs/dbraw/zinc/05/38/19/276053819.db2.gz VQOKELMVWBHSFT-OCCSQVGLSA-N 2 0 291.395 2.935 20 5 CFBDRP CC(C)c1ccc(C[NH2+][C@H]2CC[C@H](C[NH3+])C2)cc1[N+](=O)[O-] ZINC000415047302 278037789 /nfs/dbraw/zinc/03/77/89/278037789.db2.gz VQOKELMVWBHSFT-JSGCOSHPSA-N 2 0 291.395 2.935 20 5 CFBDRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccc([N+](=O)[O-])cc1 ZINC000423346225 278255517 /nfs/dbraw/zinc/25/55/17/278255517.db2.gz ZNPGVPBDMXKIGZ-LBPRGKRZSA-N 2 0 277.368 2.635 20 5 CFBDRP CC[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000423389005 288089380 /nfs/dbraw/zinc/08/93/80/288089380.db2.gz NXEOQLBGQSFBKO-YDHLFZDLSA-N 2 0 277.368 2.905 20 5 CFBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)[C@H]1CCC[NH2+]C1 ZINC000423216476 279382809 /nfs/dbraw/zinc/38/28/09/279382809.db2.gz ONAZWIANODMFEY-NFAWXSAZSA-N 2 0 291.395 2.504 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H]([C@@H](C)[NH3+])C1 ZINC000420300905 281021961 /nfs/dbraw/zinc/02/19/61/281021961.db2.gz DHXDICPFPQJHDQ-AGIUHOORSA-N 2 0 277.368 2.633 20 5 CFBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@H]2C1 ZINC000252867194 290251599 /nfs/dbraw/zinc/25/15/99/290251599.db2.gz QTZLMXSNAADVME-SHPPOPEUSA-N 2 0 289.379 2.715 20 5 CFBDRP C[C@H](CC[NH3+])[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000414889383 533900415 /nfs/dbraw/zinc/90/04/15/533900415.db2.gz SNZLSULEQBBXFU-LLVKDONJSA-N 2 0 289.335 2.682 20 5 CFBDRP CC1(C)C[C@@H]([NH3+])C[C@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C1 ZINC000925628372 618355567 /nfs/dbraw/zinc/35/55/67/618355567.db2.gz DWYDCHXVPOEDJY-KBPBESRZSA-N 2 0 291.395 2.633 20 5 CFBDRP C[C@@H]([NH2+]C[C@]12CCC[C@H]1[NH2+]CC2)c1cccc([N+](=O)[O-])c1 ZINC000925840005 619173904 /nfs/dbraw/zinc/17/39/04/619173904.db2.gz FLAVFGVHLJZENX-DAXOMENPSA-N 2 0 289.379 2.778 20 5 CFBDRP C[C@@H](C[NH2+]CC1CC[NH+](C)CC1)c1ccccc1[N+](=O)[O-] ZINC000897461027 620176865 /nfs/dbraw/zinc/17/68/65/620176865.db2.gz XIWRNWGWXWKBJM-ZDUSSCGKSA-N 2 0 291.395 2.630 20 5 CFBDRP C[C@H](C[NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2)c1ccccc1[N+](=O)[O-] ZINC000902431623 621077797 /nfs/dbraw/zinc/07/77/97/621077797.db2.gz SZXXWKIYJKSQHP-KCPJHIHWSA-N 2 0 289.379 2.558 20 5 CFBDRP C[C@@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1ccc([N+](=O)[O-])cc1 ZINC000903987551 621499707 /nfs/dbraw/zinc/49/97/07/621499707.db2.gz GUICYSDYIZOIET-KGYLQXTDSA-N 2 0 263.341 2.515 20 5 CFBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](C[NH3+])[C@H](C)C1 ZINC000923497913 626477107 /nfs/dbraw/zinc/47/71/07/626477107.db2.gz NEURJZRHJWDHIF-FRRDWIJNSA-N 2 0 277.368 2.573 20 5 CFBDRP C[C@@H]1C[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC[C@H]1C[NH3+] ZINC000923499202 626477379 /nfs/dbraw/zinc/47/73/79/626477379.db2.gz RHHBADVGRISYGJ-MNOVXSKESA-N 2 0 297.786 2.665 20 5 CFBDRP C[C@H](CCCC[NH3+])[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000841081179 631333452 /nfs/dbraw/zinc/33/34/52/631333452.db2.gz VYEBWNQWNHKJKQ-SNVBAGLBSA-N 2 0 285.775 2.855 20 5 CFBDRP C[C@@H]([NH3+])C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000843052962 631817890 /nfs/dbraw/zinc/81/78/90/631817890.db2.gz QOEOPSNHUZHVFB-SNVBAGLBSA-N 2 0 297.786 2.807 20 5 CFBDRP CC1(C)C[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C[C@@H]([NH3+])C1 ZINC000925492470 648183087 /nfs/dbraw/zinc/18/30/87/648183087.db2.gz IULWTGHGORXMNO-KGLIPLIRSA-N 2 0 291.395 2.633 20 5 CFBDRP CC(C)([NH3+])CC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000925737782 648304683 /nfs/dbraw/zinc/30/46/83/648304683.db2.gz LDYJSGZIUVBFQQ-CQSZACIVSA-N 2 0 277.368 2.689 20 5 CFBDRP CCOc1ccc([C@H](C)[NH2+]CCC(C)(C)[NH3+])cc1[N+](=O)[O-] ZINC000925739633 648305741 /nfs/dbraw/zinc/30/57/41/648305741.db2.gz BIWSNRVWNUQXHL-NSHDSACASA-N 2 0 295.383 2.772 20 5 CFBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000723887255 770706968 /nfs/dbraw/zinc/70/69/68/770706968.db2.gz KZGWIFULBJMLBL-YRGRVCCFSA-N 2 0 277.368 2.573 20 5 CFBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000723888165 770707105 /nfs/dbraw/zinc/70/71/05/770707105.db2.gz XHJJIRSVRURSRQ-FRRDWIJNSA-N 2 0 277.368 2.573 20 5 CFBDRP C[C@@H]1C[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C[C@H]1CC[NH3+] ZINC000723892656 770707632 /nfs/dbraw/zinc/70/76/32/770707632.db2.gz SZIMYCOVTHKTQY-GHMZBOCLSA-N 2 0 297.786 2.665 20 5 CFBDRP C[N+](C)(C)CCO[C@H]1CC[N@H+](Cc2ccccc2Cl)C1 ZINC001224776491 775271823 /nfs/dbraw/zinc/27/18/23/775271823.db2.gz WKNUUUFMJIYPAS-HNNXBMFYSA-N 2 0 297.850 2.637 20 5 CFBDRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000594510085 349435088 /nfs/dbraw/zinc/43/50/88/349435088.db2.gz OTUFHXFWIZCJBU-SLEUVZQESA-N 2 0 277.368 2.586 20 5 CFBDRP C[N@@H+]1CC[C@@]2(C1)CCCN(Cc1ccc([N+](=O)[O-])cc1)C2 ZINC000595508423 349645468 /nfs/dbraw/zinc/64/54/68/349645468.db2.gz XMRTVXNQUKGHEX-MRXNPFEDSA-N 2 0 289.379 2.513 20 5 CFBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC[NH2+]C ZINC000423205943 529534460 /nfs/dbraw/zinc/53/44/60/529534460.db2.gz WHQYXVBXYIQVDD-LBPRGKRZSA-N 2 0 297.424 2.665 20 5 CFBDRP [NH3+]CCC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000070188411 346907965 /nfs/dbraw/zinc/90/79/65/346907965.db2.gz FZVYBQXGKVAYRB-UHFFFAOYSA-N 2 0 297.786 2.809 20 5 CFBDRP C[NH2+]C[C@H](C)[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000596105313 349795638 /nfs/dbraw/zinc/79/56/38/349795638.db2.gz KCDCBAGIJPPXPH-GUTXKFCHSA-N 2 0 291.395 2.504 20 5 CFBDRP C[N@@H+]1CC[C@H]([NH2+]CCc2ccccc2[N+](=O)[O-])CC1(C)C ZINC000598962104 350349835 /nfs/dbraw/zinc/34/98/35/350349835.db2.gz RXIDHZPZHALECU-AWEZNQCLSA-N 2 0 291.395 2.600 20 5 CFBDRP CCC[NH+]1CCC([NH2+]CCc2cccc([N+](=O)[O-])c2)CC1 ZINC000611395167 351682199 /nfs/dbraw/zinc/68/21/99/351682199.db2.gz OMPIRCHRVBIKCN-UHFFFAOYSA-N 2 0 291.395 2.601 20 5 CFBDRP Cc1c([C@@H](C)[NH2+]CC2=CC[N@H+](C)CC2)cccc1[N+](=O)[O-] ZINC000271807963 191340187 /nfs/dbraw/zinc/34/01/87/191340187.db2.gz ADSNAQPLHQWSSN-CYBMUJFWSA-N 2 0 289.379 2.816 20 5 CFBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC1([NH3+])CCCCC1 ZINC000423187278 238262893 /nfs/dbraw/zinc/26/28/93/238262893.db2.gz XTKTUUBRIDPRFS-CYBMUJFWSA-N 2 0 291.395 2.777 20 5 CFBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)CCC2 ZINC000423216084 238282369 /nfs/dbraw/zinc/28/23/69/238282369.db2.gz RKMLPDPEDSTABE-LRDDRELGSA-N 2 0 289.379 2.561 20 5 CFBDRP CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[NH2+]CC1 ZINC000435630132 240335719 /nfs/dbraw/zinc/33/57/19/240335719.db2.gz ZSJRVRHJLZLFPT-HNNXBMFYSA-N 2 0 291.395 2.601 20 5 CFBDRP C[NH2+]CC1CC[NH+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000063159073 373788789 /nfs/dbraw/zinc/78/87/89/373788789.db2.gz KJMRPRHDGUNUIC-GFCCVEGCSA-N 2 0 277.368 2.587 20 5 CFBDRP CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)CC1CC[NH2+]CC1 ZINC000094012312 375335941 /nfs/dbraw/zinc/33/59/41/375335941.db2.gz BFZDKBCKBPJYEY-UHFFFAOYSA-N 2 0 291.395 2.805 20 5 CFBDRP CC[NH2+]CC1CC[NH+](Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000113656091 376026156 /nfs/dbraw/zinc/02/61/56/376026156.db2.gz OUHRKPXQTPEKBE-UHFFFAOYSA-N 2 0 291.395 2.725 20 5 CFBDRP [NH3+][C@H]1CCC[C@@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000414995492 381687197 /nfs/dbraw/zinc/68/71/97/381687197.db2.gz FTPBRWHZEWHHMY-PWSUYJOCSA-N 2 0 297.786 2.855 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)CC(C)(C)C[NH3+] ZINC000420287645 382342132 /nfs/dbraw/zinc/34/21/32/382342132.db2.gz IHGYCMQFGNKNGO-LBPRGKRZSA-N 2 0 279.384 2.881 20 5 CFBDRP CC[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000423389004 383079071 /nfs/dbraw/zinc/07/90/71/383079071.db2.gz NXEOQLBGQSFBKO-NFAWXSAZSA-N 2 0 277.368 2.905 20 5 CFBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)[C@@H](C)[NH3+] ZINC000423446068 383099032 /nfs/dbraw/zinc/09/90/32/383099032.db2.gz NQLLKSJJIQHDSP-GRYCIOLGSA-N 2 0 297.424 2.791 20 5 CFBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000423477577 383111767 /nfs/dbraw/zinc/11/17/67/383111767.db2.gz KBGLLELMXKKZGP-UKRRQHHQSA-N 2 0 291.395 2.648 20 5 CFBDRP CC(C)[N@H+](C)CCCN[C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000284031384 385525894 /nfs/dbraw/zinc/52/58/94/385525894.db2.gz JICVUIPJTLXQEJ-GFCCVEGCSA-N 2 0 294.399 2.558 20 5 CFBDRP Cc1c([C@@H](C)[NH2+]CCCC[NH+](C)C)cccc1[N+](=O)[O-] ZINC000268981128 132095376 /nfs/dbraw/zinc/09/53/76/132095376.db2.gz HRNVDPKDWGZOPH-CYBMUJFWSA-N 2 0 279.384 2.896 20 5 CFBDRP CC(C)([NH3+])C[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000414808840 393805981 /nfs/dbraw/zinc/80/59/81/393805981.db2.gz UKBYYCGQQTWFRQ-GXTWGEPZSA-N 2 0 291.395 2.633 20 5 CFBDRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])[C@H]2CCC[C@H]21 ZINC000353408728 163359876 /nfs/dbraw/zinc/35/98/76/163359876.db2.gz VAPGOPZNGMXGHH-IJEWVQPXSA-N 2 0 289.379 2.557 20 5 CFBDRP CCC[NH+]1CCC([NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000040675862 174373455 /nfs/dbraw/zinc/37/34/55/174373455.db2.gz ZODFBKCIHJBUMF-UHFFFAOYSA-N 2 0 291.395 2.601 20 5 CFBDRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000044517669 175190458 /nfs/dbraw/zinc/19/04/58/175190458.db2.gz ACWWRJIXUSRKIH-ZDUSSCGKSA-N 2 0 291.395 2.977 20 5 CFBDRP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000044534125 175197802 /nfs/dbraw/zinc/19/78/02/175197802.db2.gz YQKQOUWAJLXWJN-BBRMVZONSA-N 2 0 291.395 2.977 20 5 CFBDRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000332344262 274377386 /nfs/dbraw/zinc/37/73/86/274377386.db2.gz XTTJKWJQYOMSKJ-RLCCDNCMSA-N 2 0 289.379 2.560 20 5 CFBDRP Cc1cc(N[C@@H](C)C[NH+](C)C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000122212944 274718879 /nfs/dbraw/zinc/71/88/79/274718879.db2.gz UEFPOEIGXMSIMO-NSHDSACASA-N 2 0 288.351 2.813 20 5 CFBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)CCC2 ZINC000423216083 275038182 /nfs/dbraw/zinc/03/81/82/275038182.db2.gz RKMLPDPEDSTABE-BLLLJJGKSA-N 2 0 289.379 2.561 20 5 CFBDRP CC[NH+](CC)CCC[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449223718 276325527 /nfs/dbraw/zinc/32/55/27/276325527.db2.gz YQBAMDNWNIHGRW-CQSZACIVSA-N 2 0 293.411 2.847 20 5 CFBDRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1ccc([N+](=O)[O-])cc1 ZINC000423218619 278268483 /nfs/dbraw/zinc/26/84/83/278268483.db2.gz SCVZWSGULLVIBF-OBJOEFQTSA-N 2 0 277.368 2.634 20 5 CFBDRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000414804993 278318731 /nfs/dbraw/zinc/31/87/31/278318731.db2.gz FYSJCXYPLIDFEB-GFCCVEGCSA-N 2 0 285.347 2.904 20 5 CFBDRP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc([N+](=O)[O-])cc1 ZINC000423480989 278346271 /nfs/dbraw/zinc/34/62/71/278346271.db2.gz NWPRENDJPIUFJO-TZMCWYRMSA-N 2 0 277.368 2.778 20 5 CFBDRP C[C@H](C[NH3+])C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000414871576 534047959 /nfs/dbraw/zinc/04/79/59/534047959.db2.gz DHBYTEYBGNVLMA-LLVKDONJSA-N 2 0 289.335 2.539 20 5 CFBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC1([NH3+])CCCCC1 ZINC000423187279 534254391 /nfs/dbraw/zinc/25/43/91/534254391.db2.gz XTKTUUBRIDPRFS-ZDUSSCGKSA-N 2 0 291.395 2.777 20 5 CFBDRP Cc1c(C[NH2+][C@@H]2C[C@@H]([NH3+])CC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000925659470 618421639 /nfs/dbraw/zinc/42/16/39/618421639.db2.gz VAUHCRJETYFPKX-ZIAGYGMSSA-N 2 0 291.395 2.899 20 5 CFBDRP Cc1c(C[N@@H+](C)C2CCC([NH3+])CC2)cccc1[N+](=O)[O-] ZINC000091846398 618685256 /nfs/dbraw/zinc/68/52/56/618685256.db2.gz UIKJFZHEIRSPJD-UHFFFAOYSA-N 2 0 277.368 2.605 20 5 CFBDRP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccccc1[N+](=O)[O-] ZINC000897464884 620177220 /nfs/dbraw/zinc/17/72/20/620177220.db2.gz PXOKVIBPWQEIGA-HZSPNIEDSA-N 2 0 291.395 2.771 20 5 CFBDRP C[C@H](C[NH2+][C@H]1CCCCC[C@H]1[NH3+])c1ccccc1[N+](=O)[O-] ZINC000902430071 621076393 /nfs/dbraw/zinc/07/63/93/621076393.db2.gz OAXLHTRSNKDHGR-YUELXQCFSA-N 2 0 291.395 2.948 20 5 CFBDRP CC[C@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000903459489 621380623 /nfs/dbraw/zinc/38/06/23/621380623.db2.gz UIOCAEGFRDIHRA-ZLDLUXBVSA-N 2 0 277.368 2.763 20 5 CFBDRP Cc1c(C[NH2+]C2CCC([NH+](C)C)CC2)cccc1[N+](=O)[O-] ZINC000796967160 629996950 /nfs/dbraw/zinc/99/69/50/629996950.db2.gz OUTUGRWGCJYVFB-UHFFFAOYSA-N 2 0 291.395 2.866 20 5 CFBDRP [NH3+][C@@H]1CCC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000841057099 631324577 /nfs/dbraw/zinc/32/45/77/631324577.db2.gz HYMMIUABERACRS-MNOVXSKESA-N 2 0 283.759 2.608 20 5 CFBDRP C[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1ccc([N+](=O)[O-])cc1 ZINC000817946918 632749088 /nfs/dbraw/zinc/74/90/88/632749088.db2.gz HTJQUDVLWXUONR-ZDUSSCGKSA-N 2 0 299.374 2.947 20 5 CFBDRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000848562013 633289773 /nfs/dbraw/zinc/28/97/73/633289773.db2.gz FPFUZCZVUMGASE-GSJFWJNXSA-N 2 0 297.786 2.678 20 5 CFBDRP C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H](C)CC[NH+](C)C ZINC000866249596 638779819 /nfs/dbraw/zinc/77/98/19/638779819.db2.gz LWSAMKWRPSLWPN-NWDGAFQWSA-N 2 0 297.374 2.595 20 5 CFBDRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)C1 ZINC000873015635 641985121 /nfs/dbraw/zinc/98/51/21/641985121.db2.gz RKRQVRWOSQBXGU-CQSZACIVSA-N 2 0 291.395 2.643 20 5 CFBDRP Cc1c(CN[C@@H]2CCC[C@@H]([NH+](C)C)C2)cccc1[N+](=O)[O-] ZINC000873069559 642002970 /nfs/dbraw/zinc/00/29/70/642002970.db2.gz JYYLJZBRNCRHDF-HUUCEWRRSA-N 2 0 291.395 2.866 20 5 CFBDRP C[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])C1CC[NH2+]CC1 ZINC000873222393 642075302 /nfs/dbraw/zinc/07/53/02/642075302.db2.gz QKOQOXFUTUTHBX-AGLBCWCQSA-N 2 0 289.379 2.586 20 5 CFBDRP C[C@@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc([N+](=O)[O-])cc1 ZINC000873259144 642104086 /nfs/dbraw/zinc/10/40/86/642104086.db2.gz XXTZSYDVWPSYNT-RJZRQDKASA-N 2 0 289.379 2.776 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@@H](C)C2CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000873270070 642112058 /nfs/dbraw/zinc/11/20/58/642112058.db2.gz OQTLHHNVXDSPAK-STQMWFEESA-N 2 0 291.395 2.942 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)cc1[N+](=O)[O-] ZINC000925801145 648327635 /nfs/dbraw/zinc/32/76/35/648327635.db2.gz UZGFPCCYAZWWAD-VNHYZAJKSA-N 2 0 291.395 2.799 20 5 CFBDRP C[C@@H](C[N+](C)(C)C)O[C@H](CC[NH+](C)C)c1ccccc1 ZINC001224133273 775107794 /nfs/dbraw/zinc/10/77/94/775107794.db2.gz KNYXFJAFUPYSDL-DOTOQJQBSA-N 2 0 279.448 2.791 20 5 CFBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCCC[NH3+] ZINC000423318870 529418036 /nfs/dbraw/zinc/41/80/36/529418036.db2.gz DWXNDWAUBGOVSZ-GFCCVEGCSA-N 2 0 297.424 2.794 20 5 CFBDRP CC(C)[C@H]([NH3+])CC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000596652816 349969611 /nfs/dbraw/zinc/96/96/11/349969611.db2.gz IJGQCCWOIZDGJZ-CVEARBPZSA-N 2 0 291.395 2.935 20 5 CFBDRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000414826175 233368186 /nfs/dbraw/zinc/36/81/86/233368186.db2.gz VCFMZTKNRVGAJP-KCQAQPDRSA-N 2 0 291.395 2.633 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@H](C[NH3+])[C@H](C)C[C@H]1C ZINC000422560813 237103551 /nfs/dbraw/zinc/10/35/51/237103551.db2.gz HRQFFFYSXGTTAC-KYOSRNDESA-N 2 0 291.395 2.708 20 5 CFBDRP Cc1c([C@@H](C)[NH2+]C2CCC([NH3+])CC2)cccc1[N+](=O)[O-] ZINC000423210348 238278401 /nfs/dbraw/zinc/27/84/01/238278401.db2.gz FTTKTJDUCGFUCM-PNESKVBLSA-N 2 0 277.368 2.824 20 5 CFBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000423274079 238329896 /nfs/dbraw/zinc/32/98/96/238329896.db2.gz JSZNMESEKZCLBB-VHDGCEQUSA-N 2 0 291.395 2.633 20 5 CFBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423330202 238381166 /nfs/dbraw/zinc/38/11/66/238381166.db2.gz NKJSJSRQZIKXJJ-ZDUSSCGKSA-N 2 0 291.395 2.505 20 5 CFBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000423471498 238477128 /nfs/dbraw/zinc/47/71/28/238477128.db2.gz MHULIVHHCNEOKZ-UMVBOHGHSA-N 2 0 291.395 2.633 20 5 CFBDRP C[NH2+]CCC1CC[NH+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000070189031 374143935 /nfs/dbraw/zinc/14/39/35/374143935.db2.gz CIGMWAAYTRYBJD-CYBMUJFWSA-N 2 0 291.395 2.977 20 5 CFBDRP CC[NH2+]CC1CC[NH+](Cc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000347223006 381011240 /nfs/dbraw/zinc/01/12/40/381011240.db2.gz USCONSABBIWHAO-UHFFFAOYSA-N 2 0 291.395 2.725 20 5 CFBDRP [NH3+][C@@H]1CCC[C@H](C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000414986962 381681852 /nfs/dbraw/zinc/68/18/52/381681852.db2.gz CYTNQOVJQJVIBE-NBVGUUKWSA-N 2 0 289.379 2.715 20 5 CFBDRP O=[N+]([O-])c1ccccc1C[N@H+](CC[C@H]1CC[NH2+]C1)C1CC1 ZINC000420356249 382380884 /nfs/dbraw/zinc/38/08/84/382380884.db2.gz GJMKDQXMKSBTTO-CYBMUJFWSA-N 2 0 289.379 2.559 20 5 CFBDRP CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CCC[NH2+]C1 ZINC000226437028 382828731 /nfs/dbraw/zinc/82/87/31/382828731.db2.gz ATOMJUFTZJMDDO-HNNXBMFYSA-N 2 0 291.395 2.805 20 5 CFBDRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000423047048 383028336 /nfs/dbraw/zinc/02/83/36/383028336.db2.gz UOHXDLLIKHKGOZ-NXEZZACHSA-N 2 0 285.775 2.506 20 5 CFBDRP C[C@@H](C[NH3+])C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000423308906 383056522 /nfs/dbraw/zinc/05/65/22/383056522.db2.gz PFIMICFQZWZIFM-HZMBPMFUSA-N 2 0 277.368 2.502 20 5 CFBDRP C[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000423428777 383092937 /nfs/dbraw/zinc/09/29/37/383092937.db2.gz GTLZWMFEXWUDNX-KNXALSJPSA-N 2 0 289.379 2.634 20 5 CFBDRP C[NH+](C)CCCC[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000572984360 383853803 /nfs/dbraw/zinc/85/38/03/383853803.db2.gz AWMRFQCFKBERQR-AWEZNQCLSA-N 2 0 277.368 2.514 20 5 CFBDRP CC[C@@H]([NH2+][C@H]1CCC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000422842958 394256603 /nfs/dbraw/zinc/25/66/03/394256603.db2.gz ZWOZNQVDXAQHNC-DZGCQCFKSA-N 2 0 277.368 2.778 20 5 CFBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000414904493 533681381 /nfs/dbraw/zinc/68/13/81/533681381.db2.gz LTBGJVDSHCKAGB-DZGCQCFKSA-N 2 0 291.395 2.648 20 5 CFBDRP O=[N+]([O-])c1ccccc1C[N@H+](CC1CC[NH2+]CC1)C1CC1 ZINC000094021659 275039774 /nfs/dbraw/zinc/03/97/74/275039774.db2.gz XHNFAKFJNHYEOL-UHFFFAOYSA-N 2 0 289.379 2.559 20 5 CFBDRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000423438660 279254890 /nfs/dbraw/zinc/25/48/90/279254890.db2.gz ROYVXBNNJBQXIW-OLZOCXBDSA-N 2 0 279.384 2.633 20 5 CFBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000226325126 290251100 /nfs/dbraw/zinc/25/11/00/290251100.db2.gz CKCNDLFOCSCTKZ-OLZOCXBDSA-N 2 0 277.368 2.717 20 5 CFBDRP C[C@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1 ZINC000423265218 533866355 /nfs/dbraw/zinc/86/63/55/533866355.db2.gz ZRNXQRKASABJGF-QWHCGFSZSA-N 2 0 277.368 2.635 20 5 CFBDRP C[C@H](CC[NH3+])[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000414886887 533900823 /nfs/dbraw/zinc/90/08/23/533900823.db2.gz QBHMHYQGAKGTQG-LLVKDONJSA-N 2 0 289.335 2.682 20 5 CFBDRP CCC[C@H]([NH2+]CC1=CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000423348194 528217858 /nfs/dbraw/zinc/21/78/58/528217858.db2.gz SFJVTITWWSNYSL-INIZCTEOSA-N 2 0 289.379 2.945 20 5 CFBDRP C[C@@H]([NH2+][C@@H]1C[C@H]([NH3+])C12CCC2)c1ccc([N+](=O)[O-])cc1 ZINC000925826414 619153634 /nfs/dbraw/zinc/15/36/34/619153634.db2.gz MKNFFIOTRSWFKC-DDTOSNHZSA-N 2 0 275.352 2.515 20 5 CFBDRP C[C@@H]([NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2)c1ccc([N+](=O)[O-])cc1 ZINC000925826416 619153840 /nfs/dbraw/zinc/15/38/40/619153840.db2.gz MKNFFIOTRSWFKC-LERXQTSPSA-N 2 0 275.352 2.515 20 5 CFBDRP C[C@@H]([NH2+]C[C@]12CCC[C@H]1[NH2+]CC2)c1ccc([N+](=O)[O-])cc1 ZINC000925839286 619172361 /nfs/dbraw/zinc/17/23/61/619172361.db2.gz BRDRFNGPHDBJHB-DAXOMENPSA-N 2 0 289.379 2.778 20 5 CFBDRP C[C@H](CCCC[NH3+])[NH2+]C[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000902429411 621076475 /nfs/dbraw/zinc/07/64/75/621076475.db2.gz KZZRHJRJOYFUNQ-QWHCGFSZSA-N 2 0 279.384 2.805 20 5 CFBDRP C[N@@H+](Cc1ccccc1[N+](=O)[O-])CC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000903884440 621463790 /nfs/dbraw/zinc/46/37/90/621463790.db2.gz ZUQXRZOROUODCJ-LQDVMPOASA-N 2 0 289.379 2.557 20 5 CFBDRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000903975084 621493046 /nfs/dbraw/zinc/49/30/46/621493046.db2.gz WSKHRAZGQOXJGG-GHMZBOCLSA-N 2 0 297.786 2.583 20 5 CFBDRP C[C@@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccc([N+](=O)[O-])cc1 ZINC000903987423 621499413 /nfs/dbraw/zinc/49/94/13/621499413.db2.gz GEAJOEAMRAVNIE-NMFUWQPSSA-N 2 0 289.379 2.634 20 5 CFBDRP C[C@@H]([NH2+]C[C@H]1CC[NH2+][C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000903987542 621499733 /nfs/dbraw/zinc/49/97/33/621499733.db2.gz GJCJZAANJZVCRM-XQQFMLRXSA-N 2 0 277.368 2.634 20 5 CFBDRP C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC[C@@H]1C[NH3+] ZINC000904411584 621592471 /nfs/dbraw/zinc/59/24/71/621592471.db2.gz NTKRBWHJMUWSJR-GHMZBOCLSA-N 2 0 297.786 2.665 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[NH2+]CCCCCC[NH3+] ZINC000843126457 631844888 /nfs/dbraw/zinc/84/48/88/631844888.db2.gz FXNRTCICVGXOJQ-UHFFFAOYSA-N 2 0 265.357 2.512 20 5 CFBDRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872035218 641567437 /nfs/dbraw/zinc/56/74/37/641567437.db2.gz UGCJOERRVAKKCE-LLVKDONJSA-N 2 0 295.358 2.726 20 5 CFBDRP CCC[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000873256512 642102534 /nfs/dbraw/zinc/10/25/34/642102534.db2.gz OQOSROZKEZAPQJ-OSAQELSMSA-N 2 0 277.368 2.763 20 5 CFBDRP C[C@@H]([NH3+])[C@@H](NCCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000925631704 648251339 /nfs/dbraw/zinc/25/13/39/648251339.db2.gz WRUIRXFTHLNMKG-CXAGYDPISA-N 2 0 299.374 2.815 20 5 CFBDRP C[N@H+](CCCCCC[NH3+])Cc1csc([N+](=O)[O-])c1 ZINC000710752234 781336910 /nfs/dbraw/zinc/33/69/10/781336910.db2.gz XTHITBCKJCXUHP-UHFFFAOYSA-N 2 0 271.386 2.607 20 5 CFBDRP CC[C@H]([NH2+]CC1=CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000423349846 529593657 /nfs/dbraw/zinc/59/36/57/529593657.db2.gz XWPHPKKUQLKSHN-HNNXBMFYSA-N 2 0 275.352 2.555 20 5 CFBDRP C[NH2+]CCC[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000414863068 529971362 /nfs/dbraw/zinc/97/13/62/529971362.db2.gz WRRXCPKJQMLDGR-UKRRQHHQSA-N 2 0 291.395 2.505 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000591278456 349006378 /nfs/dbraw/zinc/00/63/78/349006378.db2.gz DLXZKNKBVZPGON-UKRRQHHQSA-N 2 0 291.395 2.648 20 5 CFBDRP Cc1c([C@H](C)[NH2+][C@H]2CC23CC[NH2+]CC3)cccc1[N+](=O)[O-] ZINC000591579363 349031574 /nfs/dbraw/zinc/03/15/74/349031574.db2.gz OEKPEGKJONRCNA-WFASDCNBSA-N 2 0 289.379 2.696 20 5 CFBDRP Cc1c([C@H](C)[NH2+][C@@H]2CC23CC[NH2+]CC3)cccc1[N+](=O)[O-] ZINC000591579362 349031663 /nfs/dbraw/zinc/03/16/63/349031663.db2.gz OEKPEGKJONRCNA-SWLSCSKDSA-N 2 0 289.379 2.696 20 5 CFBDRP C[C@@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000414170020 233185893 /nfs/dbraw/zinc/18/58/93/233185893.db2.gz BLPUCVHDNPXRRD-KGLIPLIRSA-N 2 0 291.395 2.977 20 5 CFBDRP [NH3+]CC1(CC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000593321025 349246642 /nfs/dbraw/zinc/24/66/42/349246642.db2.gz WPKLNZSFURUGNX-HNNXBMFYSA-N 2 0 289.379 2.691 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000415006156 233432416 /nfs/dbraw/zinc/43/24/16/233432416.db2.gz PWKXOTWUYJMERH-TZMCWYRMSA-N 2 0 277.368 2.510 20 5 CFBDRP CC(C)(C)N1CC[C@H]1C[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000602704950 350988666 /nfs/dbraw/zinc/98/86/66/350988666.db2.gz IODMHEIEWPQOCT-HNNXBMFYSA-N 2 0 291.395 2.600 20 5 CFBDRP C[NH+]1CCC2(CC[N@H+](Cc3ccccc3[N+](=O)[O-])C2)CC1 ZINC000602877667 351054684 /nfs/dbraw/zinc/05/46/84/351054684.db2.gz JBHYJAMWTOPTOJ-UHFFFAOYSA-N 2 0 289.379 2.513 20 5 CFBDRP Cc1ccc(C[NH2+]C2CCC([NH+](C)C)CC2)cc1[N+](=O)[O-] ZINC000421373349 236787573 /nfs/dbraw/zinc/78/75/73/236787573.db2.gz NQAGZBUUHOBFOU-UHFFFAOYSA-N 2 0 291.395 2.866 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@H](C[NH3+])[C@@H](C)C[C@H]1C ZINC000422560814 237104547 /nfs/dbraw/zinc/10/45/47/237104547.db2.gz HRQFFFYSXGTTAC-LNSITVRQSA-N 2 0 291.395 2.708 20 5 CFBDRP C[C@@H](CCC[NH3+])[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000422925473 237356161 /nfs/dbraw/zinc/35/61/61/237356161.db2.gz VIWZXFJCQMDGRY-ZDUSSCGKSA-N 2 0 279.384 2.635 20 5 CFBDRP Cc1c([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[NH2+]C2)cccc1[N+](=O)[O-] ZINC000423221840 238286568 /nfs/dbraw/zinc/28/65/68/238286568.db2.gz YJRCWXQZIJTSAT-MELADBBJSA-N 2 0 291.395 2.942 20 5 CFBDRP Cc1c([C@@H](C)[NH2+]CC2(C)CC[NH2+]CC2)cccc1[N+](=O)[O-] ZINC000423325979 238378994 /nfs/dbraw/zinc/37/89/94/238378994.db2.gz KHYUXGUSUPRDFW-CYBMUJFWSA-N 2 0 291.395 2.944 20 5 CFBDRP Cc1c(C[NH2+][C@H]2CCCC[C@H]2C[NH3+])cccc1[N+](=O)[O-] ZINC000231883877 189815735 /nfs/dbraw/zinc/81/57/35/189815735.db2.gz JDMYSPCJPWCFGL-JSGCOSHPSA-N 2 0 277.368 2.510 20 5 CFBDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000037644220 372681673 /nfs/dbraw/zinc/68/16/73/372681673.db2.gz ADUDLOGLTKLQOT-KBPBESRZSA-N 2 0 291.395 2.896 20 5 CFBDRP C[NH2+]CCC1CC[NH+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000070188892 374144181 /nfs/dbraw/zinc/14/41/81/374144181.db2.gz DXOBIGOUXYPTCR-ZDUSSCGKSA-N 2 0 291.395 2.977 20 5 CFBDRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000400997259 380867041 /nfs/dbraw/zinc/86/70/41/380867041.db2.gz JIPZGDSXZNGQNL-CYUUQNCZSA-N 2 0 289.379 2.634 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1 ZINC000420314340 382362237 /nfs/dbraw/zinc/36/22/37/382362237.db2.gz VOZSHEFNIRAPBG-RKLWJJNISA-N 2 0 289.379 2.633 20 5 CFBDRP O=[N+]([O-])c1ccc(C[N@H+](CC[C@H]2CC[NH2+]C2)C2CC2)cc1 ZINC000420358507 382381616 /nfs/dbraw/zinc/38/16/16/382381616.db2.gz JGTUUWWWOIUMFY-CYBMUJFWSA-N 2 0 289.379 2.559 20 5 CFBDRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)C1 ZINC000247123343 383145481 /nfs/dbraw/zinc/14/54/81/383145481.db2.gz RFWFKGHLCYYWFV-ZIAGYGMSSA-N 2 0 291.395 2.896 20 5 CFBDRP Cc1c([C@H](C)[NH2+][C@H]2CC[C@@H](C[NH3+])C2)cccc1[N+](=O)[O-] ZINC000423496394 383121287 /nfs/dbraw/zinc/12/12/87/383121287.db2.gz WTQHCQIEMJPNFS-XQQFMLRXSA-N 2 0 277.368 2.681 20 5 CFBDRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000423513820 383124761 /nfs/dbraw/zinc/12/47/61/383124761.db2.gz RONNBCIIBFATLX-PVXIVEMSSA-N 2 0 289.379 2.689 20 5 CFBDRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc([N+](=O)[O-])cc1 ZINC000423549002 383127042 /nfs/dbraw/zinc/12/70/42/383127042.db2.gz HCYMTFHCUGMPJJ-LBPRGKRZSA-N 2 0 275.352 2.555 20 5 CFBDRP CCOc1ccc([C@H](C)[NH2+][C@@H](C)CCC[NH3+])cc1[N+](=O)[O-] ZINC000423467322 383107392 /nfs/dbraw/zinc/10/73/92/383107392.db2.gz XKNBOEHXCMGZNT-RYUDHWBXSA-N 2 0 295.383 2.772 20 5 CFBDRP C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H]([C@H](C)[NH3+])C1 ZINC000251267903 383386966 /nfs/dbraw/zinc/38/69/66/383386966.db2.gz NGJYSKKUTIHDSJ-YNEHKIRRSA-N 2 0 277.368 2.715 20 5 CFBDRP CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@]1(C)CC[NH2+]C1 ZINC000261871933 383572554 /nfs/dbraw/zinc/57/25/54/383572554.db2.gz PACSQXDTQSFMCH-MRXNPFEDSA-N 2 0 291.395 2.805 20 5 CFBDRP C[N@H+](CCCC[NH2+]Cc1csc([N+](=O)[O-])c1)C1CC1 ZINC000453594968 383865052 /nfs/dbraw/zinc/86/50/52/383865052.db2.gz IYBIWPYYILSHSK-UHFFFAOYSA-N 2 0 283.397 2.620 20 5 CFBDRP CC(C)[N@H+](C)CCCN[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000219149396 393760170 /nfs/dbraw/zinc/76/01/70/393760170.db2.gz DLWZIFRUMVIULS-ZDUSSCGKSA-N 2 0 279.384 2.976 20 5 CFBDRP C[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)c1ccc([N+](=O)[O-])cc1 ZINC000423427558 394281421 /nfs/dbraw/zinc/28/14/21/394281421.db2.gz FXPGDGOBCDHJAK-KNXALSJPSA-N 2 0 289.379 2.634 20 5 CFBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]([NH3+])CC ZINC000423458774 394282751 /nfs/dbraw/zinc/28/27/51/394282751.db2.gz HGPPUPOZHVDLBC-NWDGAFQWSA-N 2 0 297.424 2.792 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+]CCC2=CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000423542867 394295028 /nfs/dbraw/zinc/29/50/28/394295028.db2.gz BHLCINANRJMUDV-ZDUSSCGKSA-N 2 0 289.379 2.864 20 5 CFBDRP C[C@H](N[C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000156581159 394335882 /nfs/dbraw/zinc/33/58/82/394335882.db2.gz NSWIAUXZTRSCDL-MBNYWOFBSA-N 2 0 277.368 2.728 20 5 CFBDRP C[NH+](C)C1CCC([NH2+]Cc2ccccc2[N+](=O)[O-])CC1 ZINC000353408049 163359046 /nfs/dbraw/zinc/35/90/46/163359046.db2.gz TUKMWFGQNBWMQK-UHFFFAOYSA-N 2 0 277.368 2.557 20 5 CFBDRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000332344265 274377401 /nfs/dbraw/zinc/37/74/01/274377401.db2.gz XTTJKWJQYOMSKJ-XFBWCDHKSA-N 2 0 289.379 2.560 20 5 CFBDRP CC(C)c1ccc(C[NH2+]CCCC[NH3+])cc1[N+](=O)[O-] ZINC000414913683 278037178 /nfs/dbraw/zinc/03/71/78/278037178.db2.gz WNLDHATVFSZTBS-UHFFFAOYSA-N 2 0 265.357 2.547 20 5 CFBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000358521089 278313097 /nfs/dbraw/zinc/31/30/97/278313097.db2.gz WWHDYXHSCDKBAD-CYBMUJFWSA-N 2 0 289.379 2.731 20 5 CFBDRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1ccccc1[N+](=O)[O-] ZINC000519564319 281308939 /nfs/dbraw/zinc/30/89/39/281308939.db2.gz WJVCEARTPRKKGH-SRVKXCTJSA-N 2 0 263.341 2.515 20 5 CFBDRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000387265497 324490123 /nfs/dbraw/zinc/49/01/23/324490123.db2.gz CNBDSDVGAMPGDY-UHFFFAOYSA-N 2 0 279.384 2.805 20 5 CFBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000423477574 534254568 /nfs/dbraw/zinc/25/45/68/534254568.db2.gz KBGLLELMXKKZGP-DZGCQCFKSA-N 2 0 291.395 2.648 20 5 CFBDRP CC1(C)C[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C[C@@H]([NH3+])C1 ZINC000925592915 618280045 /nfs/dbraw/zinc/28/00/45/618280045.db2.gz IAKDWOSQNZVPGC-OLZOCXBDSA-N 2 0 277.368 2.590 20 5 CFBDRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C1 ZINC000925592912 618280065 /nfs/dbraw/zinc/28/00/65/618280065.db2.gz IAKDWOSQNZVPGC-CHWSQXEVSA-N 2 0 277.368 2.590 20 5 CFBDRP C[C@H](C[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccccc1[N+](=O)[O-] ZINC000897464887 620177179 /nfs/dbraw/zinc/17/71/79/620177179.db2.gz PXOKVIBPWQEIGA-RDBSUJKOSA-N 2 0 291.395 2.771 20 5 CFBDRP C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H]1CC[C@H]([NH3+])C1 ZINC000903429292 621370995 /nfs/dbraw/zinc/37/09/95/621370995.db2.gz DIYCPTDDXHDCSJ-PWSUYJOCSA-N 2 0 297.786 2.807 20 5 CFBDRP C[C@@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1ccc([N+](=O)[O-])cc1 ZINC000903987554 621499451 /nfs/dbraw/zinc/49/94/51/621499451.db2.gz GUICYSDYIZOIET-WXHSDQCUSA-N 2 0 263.341 2.515 20 5 CFBDRP C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC[C@@H]1C[NH3+] ZINC000904411998 621593458 /nfs/dbraw/zinc/59/34/58/621593458.db2.gz YUXCITHDBUVPSA-ZYHUDNBSSA-N 2 0 297.786 2.665 20 5 CFBDRP CC1(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CC[NH2+]CC1 ZINC000841057527 631324458 /nfs/dbraw/zinc/32/44/58/631324458.db2.gz OOMDFVFBPZBULD-UHFFFAOYSA-N 2 0 297.786 2.728 20 5 CFBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CC1CC[NH+](C)CC1 ZINC000873044093 641993504 /nfs/dbraw/zinc/99/35/04/641993504.db2.gz BWCROIYLBFMFOW-UHFFFAOYSA-N 2 0 291.395 2.643 20 5 CFBDRP Cc1c(C[NH2+]CCCC[N@@H+](C)C2CC2)cccc1[N+](=O)[O-] ZINC000873131512 642022896 /nfs/dbraw/zinc/02/28/96/642022896.db2.gz UDHJWAHWKAQNPH-UHFFFAOYSA-N 2 0 291.395 2.867 20 5 CFBDRP C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C1CC[NH2+]CC1 ZINC000873222551 642077039 /nfs/dbraw/zinc/07/70/39/642077039.db2.gz ZDSTUBXPPNRNCU-JTQLQIEISA-N 2 0 297.786 2.726 20 5 CFBDRP C[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1ccc([N+](=O)[O-])cc1 ZINC000873270522 642112760 /nfs/dbraw/zinc/11/27/60/642112760.db2.gz WFNOWAWZLVOKSA-RYUDHWBXSA-N 2 0 277.368 2.634 20 5 CFBDRP CC1(C)C[C@@H]([NH3+])C[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000925492474 648182909 /nfs/dbraw/zinc/18/29/09/648182909.db2.gz IULWTGHGORXMNO-UONOGXRCSA-N 2 0 291.395 2.633 20 5 CFBDRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000925597333 648232979 /nfs/dbraw/zinc/23/29/79/648232979.db2.gz YIIUOWMSXSLRNZ-CHWSQXEVSA-N 2 0 277.368 2.590 20 5 CFBDRP C[C@H]([NH2+][C@@H]1C[C@H]([NH3+])C12CCC2)c1ccc([N+](=O)[O-])cc1 ZINC000925675231 648274628 /nfs/dbraw/zinc/27/46/28/648274628.db2.gz MKNFFIOTRSWFKC-LEWSCRJBSA-N 2 0 275.352 2.515 20 5 CFBDRP Cc1c([C@@H](C)[NH2+]CC[C@@H]2C[NH2+]C[C@H]2C)cccc1[N+](=O)[O-] ZINC000925795628 648326591 /nfs/dbraw/zinc/32/65/91/648326591.db2.gz HHQRUCKITCEFGU-MRVWCRGKSA-N 2 0 291.395 2.799 20 5 CFBDRP C[N+](C)(C)CCO[C@H]1CC[N@H+](Cc2ccc(Cl)cc2)C1 ZINC001224775947 778681432 /nfs/dbraw/zinc/68/14/32/778681432.db2.gz QDGQXKDCAXXCLQ-INIZCTEOSA-N 2 0 297.850 2.637 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000594512005 349436554 /nfs/dbraw/zinc/43/65/54/349436554.db2.gz SRSWPXAPWKQDQQ-NFAWXSAZSA-N 2 0 291.395 2.894 20 5 CFBDRP Cc1c([C@@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C)cccc1[N+](=O)[O-] ZINC000596651951 349968792 /nfs/dbraw/zinc/96/87/92/349968792.db2.gz DCQUFEVXSOVGJK-TZMCWYRMSA-N 2 0 279.384 2.927 20 5 CFBDRP Cc1c([C@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C)cccc1[N+](=O)[O-] ZINC000596651250 349968873 /nfs/dbraw/zinc/96/88/73/349968873.db2.gz DCQUFEVXSOVGJK-GXTWGEPZSA-N 2 0 279.384 2.927 20 5 CFBDRP CC(C)[C@H]([NH3+])CC[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000596654409 349969199 /nfs/dbraw/zinc/96/91/99/349969199.db2.gz OHYFPCLFZFVYRH-BXUZGUMPSA-N 2 0 265.357 2.619 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000273353478 192122998 /nfs/dbraw/zinc/12/29/98/192122998.db2.gz BJCSFIWNSVJVSS-UHFFFAOYSA-N 2 0 291.395 2.725 20 5 CFBDRP C[C@@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])[C@H]1CC[NH3+] ZINC000404314094 348590320 /nfs/dbraw/zinc/59/03/20/348590320.db2.gz AFADDNVFJLPFQQ-OCCSQVGLSA-N 2 0 277.368 2.544 20 5 CFBDRP Cc1c(C[N@H+]2CCC[C@H](C)[C@H]2CC[NH3+])cccc1[N+](=O)[O-] ZINC000404382709 348591394 /nfs/dbraw/zinc/59/13/94/348591394.db2.gz NCMZXYMDCYCQBX-SWLSCSKDSA-N 2 0 291.395 2.853 20 5 CFBDRP Cc1c([C@H](C)[NH2+][C@@H]2CCC[NH2+]CC2)cccc1[N+](=O)[O-] ZINC000591578241 349031907 /nfs/dbraw/zinc/03/19/07/349031907.db2.gz DVUVURYFOYLHHC-QWHCGFSZSA-N 2 0 277.368 2.696 20 5 CFBDRP C[NH2+]Cc1ccccc1C[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000593315850 349245641 /nfs/dbraw/zinc/24/56/41/349245641.db2.gz FVZUINGOFRUXEY-UHFFFAOYSA-N 2 0 285.347 2.604 20 5 CFBDRP C[C@H]([NH2+]CCC1CC[NH2+]CC1)c1ccc([N+](=O)[O-])cc1 ZINC000593323976 349247212 /nfs/dbraw/zinc/24/72/12/349247212.db2.gz UZPCIRYHHPVQGW-LBPRGKRZSA-N 2 0 277.368 2.635 20 5 CFBDRP C[C@@H]1C[C@@H](C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)CC[NH2+]1 ZINC000414712748 233335508 /nfs/dbraw/zinc/33/55/08/233335508.db2.gz OGVQHBQIHYPKSV-OLZOCXBDSA-N 2 0 291.395 2.808 20 5 CFBDRP C[C@H]([NH3+])CC[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000414826172 233367767 /nfs/dbraw/zinc/36/77/67/233367767.db2.gz VCFMZTKNRVGAJP-GUTXKFCHSA-N 2 0 291.395 2.633 20 5 CFBDRP Cc1ccc(CNC[C@@H]2CCCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000598994051 350356302 /nfs/dbraw/zinc/35/63/02/350356302.db2.gz GIAXBURSPCURFS-HNNXBMFYSA-N 2 0 291.395 2.725 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H]1CC[NH2+]CC(C)(C)C1 ZINC000601969292 350821951 /nfs/dbraw/zinc/82/19/51/350821951.db2.gz BLTODOUJAYQYTM-CQSZACIVSA-N 2 0 291.395 2.771 20 5 CFBDRP C[N@H+](CCCC[NH2+]CCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000602687267 350979734 /nfs/dbraw/zinc/97/97/34/350979734.db2.gz JLHXDTORGUSVQE-UHFFFAOYSA-N 2 0 291.395 2.601 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1C[C@@H]([NH3+])C1(C)C ZINC000603431713 351163942 /nfs/dbraw/zinc/16/39/42/351163942.db2.gz GJNPGBZDGTWTRA-ZLKJLUDKSA-N 2 0 277.368 2.680 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421370071 236784419 /nfs/dbraw/zinc/78/44/19/236784419.db2.gz IPRVHHJSCXEJFW-UHFFFAOYSA-N 2 0 291.395 2.866 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@H](C)C[C@@H](C)[NH3+])cc1[N+](=O)[O-] ZINC000422918358 237345592 /nfs/dbraw/zinc/34/55/92/237345592.db2.gz HDMGAEPAOULAQY-UTUOFQBUSA-N 2 0 265.357 2.680 20 5 CFBDRP Cc1c([C@H](C)[NH2+]CC2(C)CC[NH2+]CC2)cccc1[N+](=O)[O-] ZINC000423325980 238377908 /nfs/dbraw/zinc/37/79/08/238377908.db2.gz KHYUXGUSUPRDFW-ZDUSSCGKSA-N 2 0 291.395 2.944 20 5 CFBDRP C[C@@H](CCC[NH3+])[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000423464960 238472349 /nfs/dbraw/zinc/47/23/49/238472349.db2.gz WCMZBFNDHPMWFG-WFASDCNBSA-N 2 0 291.395 2.633 20 5 CFBDRP C[NH+](C)CCC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000056522686 373567128 /nfs/dbraw/zinc/56/71/28/373567128.db2.gz DJOPUXRAUFOZRB-UHFFFAOYSA-N 2 0 291.395 2.759 20 5 CFBDRP Cc1c(C[NH2+][C@@H](C)CCCC[NH3+])cccc1[N+](=O)[O-] ZINC000336818400 380682401 /nfs/dbraw/zinc/68/24/01/380682401.db2.gz VKEYGSCHHJVACU-NSHDSACASA-N 2 0 265.357 2.510 20 5 CFBDRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000400997264 380867341 /nfs/dbraw/zinc/86/73/41/380867341.db2.gz JIPZGDSXZNGQNL-SPWCGHHHSA-N 2 0 289.379 2.634 20 5 CFBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000358507697 380893802 /nfs/dbraw/zinc/89/38/02/380893802.db2.gz LCPOOKURUNEXPW-CYBMUJFWSA-N 2 0 289.379 2.731 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000414948403 381638246 /nfs/dbraw/zinc/63/82/46/381638246.db2.gz XZKJENZXVYEUOR-NFAWXSAZSA-N 2 0 291.395 2.504 20 5 CFBDRP O=[N+]([O-])c1ccccc1/C=C\C[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000414967110 381664043 /nfs/dbraw/zinc/66/40/43/381664043.db2.gz GVUSMNKBVFLGAO-FTWHOSCRSA-N 2 0 289.379 2.730 20 5 CFBDRP C[C@H](CCCC[NH3+])[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000415016896 381711991 /nfs/dbraw/zinc/71/19/91/381711991.db2.gz QOLVYFUSJIEHMA-OYVUYXNMSA-N 2 0 277.368 2.715 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+]CC[C@H]2CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000420413193 382403172 /nfs/dbraw/zinc/40/31/72/382403172.db2.gz SUKSLOVHDBACMD-UONOGXRCSA-N 2 0 291.395 2.944 20 5 CFBDRP CN1CCC([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192617658 382710632 /nfs/dbraw/zinc/71/06/32/382710632.db2.gz STUCUZNYXDQGHR-MRXNPFEDSA-N 2 0 289.379 2.656 20 5 CFBDRP CC(C)C[NH+]1CCC(NCc2ccccc2[N+](=O)[O-])CC1 ZINC000227436598 382837250 /nfs/dbraw/zinc/83/72/50/382837250.db2.gz ZQRAKZHVVVOZNP-UHFFFAOYSA-N 2 0 291.395 2.805 20 5 CFBDRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000227497372 382837279 /nfs/dbraw/zinc/83/72/79/382837279.db2.gz UMXXZPAZASIXHV-CYBMUJFWSA-N 2 0 291.395 2.977 20 5 CFBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CC[C@H]1CCC[NH2+]1)CCC2 ZINC000423355097 383062676 /nfs/dbraw/zinc/06/26/76/383062676.db2.gz DVEIJQAKIZAYRD-CZUORRHYSA-N 2 0 289.379 2.704 20 5 CFBDRP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000423433433 383094890 /nfs/dbraw/zinc/09/48/90/383094890.db2.gz CJIATJDVNQFWAC-RMRHIDDWSA-N 2 0 291.395 2.631 20 5 CFBDRP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc([N+](=O)[O-])cc1 ZINC000423480987 383114442 /nfs/dbraw/zinc/11/44/42/383114442.db2.gz NWPRENDJPIUFJO-JSGCOSHPSA-N 2 0 277.368 2.778 20 5 CFBDRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1cccc([N+](=O)[O-])c1 ZINC000570162283 383577855 /nfs/dbraw/zinc/57/78/55/383577855.db2.gz JDAMWKCGZLZBPS-GFCCVEGCSA-N 2 0 285.347 2.904 20 5 CFBDRP C[N@H+](CCCC[NH2+]Cc1ccc([N+](=O)[O-])cc1F)C1CC1 ZINC000453600171 383869502 /nfs/dbraw/zinc/86/95/02/383869502.db2.gz RQMUMMWOFASHNR-UHFFFAOYSA-N 2 0 295.358 2.698 20 5 CFBDRP C[C@H](N[C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccccc1[N+](=O)[O-] ZINC000252647883 131136441 /nfs/dbraw/zinc/13/64/41/131136441.db2.gz UVKVZUSXEAUBKQ-MJBXVCDLSA-N 2 0 289.379 2.872 20 5 CFBDRP Cc1c([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](C)C2)cccc1[N+](=O)[O-] ZINC000158176024 394355131 /nfs/dbraw/zinc/35/51/31/394355131.db2.gz GCAJITAUAGNHOW-ZIAGYGMSSA-N 2 0 291.395 2.896 20 5 CFBDRP C[NH+]1CCC2(CCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000374326495 157100214 /nfs/dbraw/zinc/10/02/14/157100214.db2.gz SOGPIGCUJDJACR-UHFFFAOYSA-N 2 0 289.379 2.655 20 5 CFBDRP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000044534127 175196834 /nfs/dbraw/zinc/19/68/34/175196834.db2.gz YQKQOUWAJLXWJN-XJKSGUPXSA-N 2 0 291.395 2.977 20 5 CFBDRP [NH3+]CC[C@@H]1CCC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000442920097 227211590 /nfs/dbraw/zinc/21/15/90/227211590.db2.gz GJPDKECVIVANKO-ZBKLQPJUSA-N 2 0 289.379 2.669 20 5 CFBDRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000423147129 278227343 /nfs/dbraw/zinc/22/73/43/278227343.db2.gz RBRYDRFTECSWHU-RYUDHWBXSA-N 2 0 265.357 2.763 20 5 CFBDRP CC[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000423383803 288090498 /nfs/dbraw/zinc/09/04/98/288090498.db2.gz FGXPXNWZWQEKJR-UGFHNGPFSA-N 2 0 277.368 2.634 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@@H](C[NH3+])C[C@@H]1C ZINC000420319809 281022826 /nfs/dbraw/zinc/02/28/26/281022826.db2.gz POASBYLIXRTGCZ-RWMBFGLXSA-N 2 0 277.368 2.633 20 5 CFBDRP [NH3+]CCCC[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000414899883 534606035 /nfs/dbraw/zinc/60/60/35/534606035.db2.gz GUWZVBJKQHYTGR-UHFFFAOYSA-N 2 0 289.335 2.683 20 5 CFBDRP CCC[C@@H]([NH2+]CC[C@H](C)[NH3+])c1cccc([N+](=O)[O-])c1 ZINC000423224846 529008450 /nfs/dbraw/zinc/00/84/50/529008450.db2.gz CWGFEVHWHYHFMC-SMDDNHRTSA-N 2 0 265.357 2.763 20 5 CFBDRP CC1(C)C[C@@H]([NH2+]CCc2ccccc2[N+](=O)[O-])C[C@@H]([NH3+])C1 ZINC000925517270 618855568 /nfs/dbraw/zinc/85/55/68/618855568.db2.gz ZSKKSNXBHUGJMF-KGLIPLIRSA-N 2 0 291.395 2.633 20 5 CFBDRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000902429409 621076665 /nfs/dbraw/zinc/07/66/65/621076665.db2.gz KZZRHJRJOYFUNQ-CHWSQXEVSA-N 2 0 279.384 2.805 20 5 CFBDRP C[C@H](C[NH2+][C@@H]1CCCC[C@H]1C[NH3+])c1ccccc1[N+](=O)[O-] ZINC000902432116 621077482 /nfs/dbraw/zinc/07/74/82/621077482.db2.gz VDSJXHZAXDSBOS-VNHYZAJKSA-N 2 0 291.395 2.805 20 5 CFBDRP C[C@H](C[NH2+][C@@H]1CC[NH2+]CC[C@H]1C)c1ccccc1[N+](=O)[O-] ZINC000902432068 621077699 /nfs/dbraw/zinc/07/76/99/621077699.db2.gz UUKQFUFDQOHFIY-UMVBOHGHSA-N 2 0 291.395 2.676 20 5 CFBDRP C[C@H](C[NH2+][C@H]1CCCC[C@@H]1C[NH3+])c1ccccc1[N+](=O)[O-] ZINC000902432114 621077932 /nfs/dbraw/zinc/07/79/32/621077932.db2.gz VDSJXHZAXDSBOS-NFAWXSAZSA-N 2 0 291.395 2.805 20 5 CFBDRP C[C@@H]1C[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CC[C@@H]1C[NH3+] ZINC000923499739 626477490 /nfs/dbraw/zinc/47/74/90/626477490.db2.gz SXNIDBYBPLCHAZ-GHMZBOCLSA-N 2 0 297.786 2.665 20 5 CFBDRP CC(C)(C)[C@@]1(C[NH3+])CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000866704271 638868385 /nfs/dbraw/zinc/86/83/85/638868385.db2.gz SGXODXDUYJFRFU-MRXNPFEDSA-N 2 0 291.395 2.792 20 5 CFBDRP CC(C)(C)[C@@]1(C[NH3+])CC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000866705175 638868405 /nfs/dbraw/zinc/86/84/05/638868405.db2.gz VCMJSQOOQCKAEC-MRXNPFEDSA-N 2 0 291.395 2.792 20 5 CFBDRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872030147 641560192 /nfs/dbraw/zinc/56/01/92/641560192.db2.gz ZWXWWRNWHCBWFE-LLVKDONJSA-N 2 0 283.347 2.726 20 5 CFBDRP Cc1c([C@H](C)[NH2+][C@@H](C)C2CC[NH2+]CC2)cccc1[N+](=O)[O-] ZINC000873272960 642113484 /nfs/dbraw/zinc/11/34/84/642113484.db2.gz XXALLCINJNTRAX-STQMWFEESA-N 2 0 291.395 2.942 20 5 CFBDRP CC1(C)C[C@@H]([NH3+])C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000925597336 648232658 /nfs/dbraw/zinc/23/26/58/648232658.db2.gz YIIUOWMSXSLRNZ-STQMWFEESA-N 2 0 277.368 2.590 20 5 CFBDRP C[C@@H](c1ccccc1[N+](=O)[O-])N1C[C@@H]2C[N@H+](C)C[C@]2(C)C1 ZINC000933739963 649718753 /nfs/dbraw/zinc/71/87/53/649718753.db2.gz DUQGEDPZHDRBTQ-HEHGZKQESA-N 2 0 289.379 2.539 20 5 CFBDRP C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1OCCC[N+](C)(C)C ZINC001224621517 775229880 /nfs/dbraw/zinc/22/98/80/775229880.db2.gz WQISYTLJQXAMJQ-WMZOPIPTSA-N 2 0 291.459 2.620 20 5 CFBDRP CC(C)[C@H]([NH3+])CC[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000596101326 349794630 /nfs/dbraw/zinc/79/46/30/349794630.db2.gz FVELCTHEIHBPDM-HZRUHFOJSA-N 2 0 277.368 2.571 20 5 CFBDRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000596652817 349969548 /nfs/dbraw/zinc/96/95/48/349969548.db2.gz IJGQCCWOIZDGJZ-HZPDHXFCSA-N 2 0 291.395 2.935 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C)cc1[N+](=O)[O-] ZINC000596655343 349970511 /nfs/dbraw/zinc/97/05/11/349970511.db2.gz VMVNCFQPCHVSOA-GXTWGEPZSA-N 2 0 279.384 2.927 20 5 CFBDRP CC[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2Cl)CC[C@@H]1[NH3+] ZINC000122782128 347816958 /nfs/dbraw/zinc/81/69/58/347816958.db2.gz PBJNBIVUXXVFPK-HZMBPMFUSA-N 2 0 297.786 2.807 20 5 CFBDRP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000414806555 233359592 /nfs/dbraw/zinc/35/95/92/233359592.db2.gz HRBCJDORTVBVOX-LBPRGKRZSA-N 2 0 285.347 2.904 20 5 CFBDRP O=[N+]([O-])c1ccc(C[NH2+]CC[C@@H]2CCC[NH2+]C2)c(Cl)c1 ZINC000414837026 233372553 /nfs/dbraw/zinc/37/25/53/233372553.db2.gz JYTKXURDHHHOFU-NSHDSACASA-N 2 0 297.786 2.728 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)CCCC[NH3+] ZINC000415021358 233439340 /nfs/dbraw/zinc/43/93/40/233439340.db2.gz YJCILKCWXYDLGE-LBPRGKRZSA-N 2 0 265.357 2.510 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000422920539 237350168 /nfs/dbraw/zinc/35/01/68/237350168.db2.gz MXXZNEKBAHRLOV-YDHLFZDLSA-N 2 0 291.395 2.942 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000422920538 237351434 /nfs/dbraw/zinc/35/14/34/237351434.db2.gz MXXZNEKBAHRLOV-KCQAQPDRSA-N 2 0 291.395 2.942 20 5 CFBDRP Cc1c([C@@H](C)[NH2+]C[C@H]2CCC[NH2+]C2)cccc1[N+](=O)[O-] ZINC000423211351 238281609 /nfs/dbraw/zinc/28/16/09/238281609.db2.gz KZCFVOHJEPHWGB-OLZOCXBDSA-N 2 0 277.368 2.553 20 5 CFBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)[C@@H]1CCC[NH2+]C1 ZINC000423216478 238283694 /nfs/dbraw/zinc/28/36/94/238283694.db2.gz ONAZWIANODMFEY-UMVBOHGHSA-N 2 0 291.395 2.504 20 5 CFBDRP Cc1c([C@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)cccc1[N+](=O)[O-] ZINC000423245768 238304379 /nfs/dbraw/zinc/30/43/79/238304379.db2.gz JJMYUPJGBPKABK-STQMWFEESA-N 2 0 277.368 2.553 20 5 CFBDRP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](CC)C1)c1cccc([N+](=O)[O-])c1 ZINC000037644168 372680596 /nfs/dbraw/zinc/68/05/96/372680596.db2.gz BXRCZWCDZJGMDY-CZUORRHYSA-N 2 0 291.395 2.977 20 5 CFBDRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000037649075 372685380 /nfs/dbraw/zinc/68/53/80/372685380.db2.gz RLMAZQJYXUPRKH-QWHCGFSZSA-N 2 0 289.379 2.730 20 5 CFBDRP O=[N+]([O-])c1ccc(C[N@H+](CC2CC[NH2+]CC2)C2CC2)cc1 ZINC000094021512 375335513 /nfs/dbraw/zinc/33/55/13/375335513.db2.gz JQPZCVGTQTZCBK-UHFFFAOYSA-N 2 0 289.379 2.559 20 5 CFBDRP CC[N@@H+]1CC[C@H](N(C)Cc2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000174776301 379937494 /nfs/dbraw/zinc/93/74/94/379937494.db2.gz LAGADGYPMJXLDN-CJNGLKHVSA-N 2 0 291.395 2.757 20 5 CFBDRP C[C@H]([NH3+])C1CC[NH+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000347183468 380990279 /nfs/dbraw/zinc/99/02/79/380990279.db2.gz XHBXSHCNBBNIBW-AGLBCWCQSA-N 2 0 289.379 2.667 20 5 CFBDRP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000414181079 381568498 /nfs/dbraw/zinc/56/84/98/381568498.db2.gz MMLJJJYWOUBHIY-KBPBESRZSA-N 2 0 291.395 2.977 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000414933560 381624725 /nfs/dbraw/zinc/62/47/25/381624725.db2.gz XAJPAJSCSNBKCV-VHDGCEQUSA-N 2 0 291.395 2.775 20 5 CFBDRP CC(C)c1ccc(C[NH2+][C@@H](C)CCC[NH3+])cc1[N+](=O)[O-] ZINC000415028303 381721593 /nfs/dbraw/zinc/72/15/93/381721593.db2.gz YMMIZNJDVODNEV-LBPRGKRZSA-N 2 0 279.384 2.935 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000420418630 382403210 /nfs/dbraw/zinc/40/32/10/382403210.db2.gz XBWQOSKNUFIEHT-CHWSQXEVSA-N 2 0 277.368 2.553 20 5 CFBDRP CCOc1ccc([C@H](C)[NH2+][C@H](C)CCC[NH3+])cc1[N+](=O)[O-] ZINC000423467316 383107417 /nfs/dbraw/zinc/10/74/17/383107417.db2.gz XKNBOEHXCMGZNT-NEPJUHHUSA-N 2 0 295.383 2.772 20 5 CFBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCC[C@H]([NH3+])C1 ZINC000423471496 383108577 /nfs/dbraw/zinc/10/85/77/383108577.db2.gz MHULIVHHCNEOKZ-IPYPFGDCSA-N 2 0 291.395 2.633 20 5 CFBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000431039830 383625632 /nfs/dbraw/zinc/62/56/32/383625632.db2.gz YLVVFLHHLFPHFB-ZDUSSCGKSA-N 2 0 289.379 2.731 20 5 CFBDRP C[N@H+](CCCC[NH2+]Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000453596406 383865765 /nfs/dbraw/zinc/86/57/65/383865765.db2.gz LBRBUNSIOJUXSB-UHFFFAOYSA-N 2 0 277.368 2.559 20 5 CFBDRP C[C@@H](CC[NH3+])[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000414889386 533579938 /nfs/dbraw/zinc/57/99/38/533579938.db2.gz SNZLSULEQBBXFU-NSHDSACASA-N 2 0 289.335 2.682 20 5 CFBDRP CC[NH+](CC)CCCN(C)Cc1ccccc1[N+](=O)[O-] ZINC000193469138 393653434 /nfs/dbraw/zinc/65/34/34/393653434.db2.gz CNZIFIOIGMAKNZ-UHFFFAOYSA-N 2 0 279.384 2.759 20 5 CFBDRP Cc1c([C@H](C)[NH2+]CCC2=CC[NH2+]CC2)cccc1[N+](=O)[O-] ZINC000423546075 394295650 /nfs/dbraw/zinc/29/56/50/394295650.db2.gz YMKPDYUFSNSTOH-ZDUSSCGKSA-N 2 0 289.379 2.864 20 5 CFBDRP Cc1c([C@@H](C)[NH2+]CCC2=CC[NH2+]CC2)cccc1[N+](=O)[O-] ZINC000423546074 394295856 /nfs/dbraw/zinc/29/58/56/394295856.db2.gz YMKPDYUFSNSTOH-CYBMUJFWSA-N 2 0 289.379 2.864 20 5 CFBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)CCC2 ZINC000423247047 275037946 /nfs/dbraw/zinc/03/79/46/275037946.db2.gz KOBHCRZSKBWEPO-WBMJQRKESA-N 2 0 289.379 2.561 20 5 CFBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)[C@H]1CCC[NH2+]C1 ZINC000423216474 279382306 /nfs/dbraw/zinc/38/23/06/279382306.db2.gz ONAZWIANODMFEY-IPYPFGDCSA-N 2 0 291.395 2.504 20 5 CFBDRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000565783501 290325385 /nfs/dbraw/zinc/32/53/85/290325385.db2.gz BAJWKSDWANSDSN-HUUCEWRRSA-N 2 0 291.395 2.777 20 5 CFBDRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000332298320 295306482 /nfs/dbraw/zinc/30/64/82/295306482.db2.gz MRCZVQULAYPHIM-XJKCOSOUSA-N 2 0 289.379 2.832 20 5 CFBDRP CCC[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000423348195 529006327 /nfs/dbraw/zinc/00/63/27/529006327.db2.gz SFJVTITWWSNYSL-MRXNPFEDSA-N 2 0 289.379 2.945 20 5 CFBDRP C[C@H](CC[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-])[NH+](C)C ZINC000895292254 618514805 /nfs/dbraw/zinc/51/48/05/618514805.db2.gz ALKHFBLGOQAYAZ-UONOGXRCSA-N 2 0 293.411 2.846 20 5 CFBDRP CC1(C)C[C@H]([NH3+])C[C@@H]([NH2+]CCc2ccccc2[N+](=O)[O-])C1 ZINC000925517275 618855778 /nfs/dbraw/zinc/85/57/78/618855778.db2.gz ZSKKSNXBHUGJMF-ZIAGYGMSSA-N 2 0 291.395 2.633 20 5 CFBDRP C[C@H](C[NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1ccccc1[N+](=O)[O-] ZINC000902430047 621076624 /nfs/dbraw/zinc/07/66/24/621076624.db2.gz NOHZSBIMURPRFO-UPJWGTAASA-N 2 0 277.368 2.558 20 5 CFBDRP C[C@H](C[NH2+][C@H]1CC[NH2+]CC[C@H]1C)c1ccccc1[N+](=O)[O-] ZINC000902432067 621077833 /nfs/dbraw/zinc/07/78/33/621077833.db2.gz UUKQFUFDQOHFIY-NFAWXSAZSA-N 2 0 291.395 2.676 20 5 CFBDRP CC1(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CC[NH2+]CC1 ZINC000841057928 631325977 /nfs/dbraw/zinc/32/59/77/631325977.db2.gz SHGFQRKZMLGUKN-UHFFFAOYSA-N 2 0 297.786 2.728 20 5 CFBDRP C[N@H+](CCCCCCC[NH3+])Cc1ccccc1[N+](=O)[O-] ZINC000842471680 631639145 /nfs/dbraw/zinc/63/91/45/631639145.db2.gz RQIYEJPILCISJH-UHFFFAOYSA-N 2 0 279.384 2.936 20 5 CFBDRP COc1ccc([N+](=O)[O-])cc1C[N@H+](C)CCCCCC[NH3+] ZINC000872154915 641676055 /nfs/dbraw/zinc/67/60/55/641676055.db2.gz FEPKFQPUFYTABH-UHFFFAOYSA-N 2 0 295.383 2.554 20 5 CFBDRP Cc1ccc([N+](=O)[O-])c(C)c1CN[C@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000873060295 641998900 /nfs/dbraw/zinc/99/89/00/641998900.db2.gz HOXQDKBHVXQYRA-JSGCOSHPSA-N 2 0 291.395 2.784 20 5 CFBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CC1=CC[N@H+](C)CC1 ZINC000873101499 642013572 /nfs/dbraw/zinc/01/35/72/642013572.db2.gz WKYRJRVXHZTZPG-UHFFFAOYSA-N 2 0 289.379 2.563 20 5 CFBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000873132835 642022990 /nfs/dbraw/zinc/02/29/90/642022990.db2.gz HPLQBMZLTFHSGD-OKILXGFUSA-N 2 0 291.395 2.641 20 5 CFBDRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000877073213 643135337 /nfs/dbraw/zinc/13/53/37/643135337.db2.gz FNXCLVYHILKGAC-GDBMZVCRSA-N 2 0 291.395 2.600 20 5 CFBDRP O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000093452419 650940323 /nfs/dbraw/zinc/94/03/23/650940323.db2.gz ZWGLEMANQZBUNB-OWCLPIDISA-N 2 0 289.379 2.605 20 5 CFBDRP C[NH+]1C(C)(C)CC(OCCC[N+](C)(C)C)CC1(C)C ZINC001224621746 775229970 /nfs/dbraw/zinc/22/99/70/775229970.db2.gz CROSMDXNIBMYMX-UHFFFAOYSA-N 2 0 271.469 2.751 20 5 CFBDRP CC[N+](C)(C)Cc1ccccc1NC1C[NH+](C(C)C)C1 ZINC001168316344 778429154 /nfs/dbraw/zinc/42/91/54/778429154.db2.gz XBBSGESWLPXZLU-UHFFFAOYSA-N 2 0 276.448 2.787 20 5 CFBDRP C[N@H+](CCCCCC[NH3+])CCc1ccccc1[N+](=O)[O-] ZINC000710840689 781341538 /nfs/dbraw/zinc/34/15/38/781341538.db2.gz AGQVPEYDTRTIDV-UHFFFAOYSA-N 2 0 279.384 2.588 20 5 CFBDRP C[N@H+](CCCCCC[NH3+])CCc1ccc([N+](=O)[O-])cc1 ZINC000710840693 781341543 /nfs/dbraw/zinc/34/15/43/781341543.db2.gz ALUYWNIWWVRUHP-UHFFFAOYSA-N 2 0 279.384 2.588 20 5 CFBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC(C)(C)[NH3+] ZINC000423289319 529418113 /nfs/dbraw/zinc/41/81/13/529418113.db2.gz WTGZGPSYZJGRQL-LLVKDONJSA-N 2 0 297.424 2.792 20 5 CFBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC[C@H](C)[NH3+] ZINC000423223088 529534221 /nfs/dbraw/zinc/53/42/21/529534221.db2.gz DTUUUTGYBJECHT-RYUDHWBXSA-N 2 0 297.424 2.792 20 5 CFBDRP C[C@@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]1CCC[NH3+] ZINC000595904792 349765371 /nfs/dbraw/zinc/76/53/71/349765371.db2.gz LBYBKVFEPICXEO-UKRRQHHQSA-N 2 0 291.395 2.934 20 5 CFBDRP C[NH2+]CCC[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000414863065 529971710 /nfs/dbraw/zinc/97/17/10/529971710.db2.gz WRRXCPKJQMLDGR-HIFRSBDPSA-N 2 0 291.395 2.505 20 5 CFBDRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000596654410 349969306 /nfs/dbraw/zinc/96/93/06/349969306.db2.gz OHYFPCLFZFVYRH-SMDDNHRTSA-N 2 0 265.357 2.619 20 5 CFBDRP C[C@@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@H]1CC[NH3+] ZINC000404414435 348591648 /nfs/dbraw/zinc/59/16/48/348591648.db2.gz FIDVPGMXFVWUHJ-DOMZBBRYSA-N 2 0 277.368 2.544 20 5 CFBDRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000414793845 233353839 /nfs/dbraw/zinc/35/38/39/233353839.db2.gz FDXKEALAZSWEQP-DNWYELSFSA-N 2 0 289.379 2.715 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000414827329 233367860 /nfs/dbraw/zinc/36/78/60/233367860.db2.gz KJFPKPAAMDNOEN-KGLIPLIRSA-N 2 0 291.395 2.505 20 5 CFBDRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000271813948 191342052 /nfs/dbraw/zinc/34/20/52/191342052.db2.gz BESRREJSRJJEAY-LBPRGKRZSA-N 2 0 275.352 2.507 20 5 CFBDRP [NH3+][C@H]1C[C@H]([NH2+]CCc2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000422778564 237195763 /nfs/dbraw/zinc/19/57/63/237195763.db2.gz ASMWFIKXXCVFNM-HOTGVXAUSA-N 2 0 297.358 2.872 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@@H](C)CCC[NH3+])cc1[N+](=O)[O-] ZINC000422917967 237344481 /nfs/dbraw/zinc/34/44/81/237344481.db2.gz GKUUFAWZGNGQEL-RYUDHWBXSA-N 2 0 265.357 2.681 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000422920537 237348399 /nfs/dbraw/zinc/34/83/99/237348399.db2.gz MXXZNEKBAHRLOV-GZBFAFLISA-N 2 0 291.395 2.942 20 5 CFBDRP C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@H]1CCC[NH2+]CC1 ZINC000435433405 240315184 /nfs/dbraw/zinc/31/51/84/240315184.db2.gz NKNYRDBJOKGDFJ-ZKKXHLJNSA-N 2 0 289.379 2.682 20 5 CFBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](CC[NH3+])C1 ZINC000070169610 374134963 /nfs/dbraw/zinc/13/49/63/374134963.db2.gz OJFWLZPPMOBLJS-QWHCGFSZSA-N 2 0 277.368 2.717 20 5 CFBDRP C[N@@H+]1CCCC12CCN(Cc1cccc([N+](=O)[O-])c1)CC2 ZINC000370653276 381484851 /nfs/dbraw/zinc/48/48/51/381484851.db2.gz YAXCASTVGJCKEC-UHFFFAOYSA-N 2 0 289.379 2.655 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC000414954935 381646964 /nfs/dbraw/zinc/64/69/64/381646964.db2.gz SYIGFRJMAAOXCK-NFAWXSAZSA-N 2 0 291.395 2.646 20 5 CFBDRP CC1(C)C[NH2+]CC[C@@H]1[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000414968423 381666136 /nfs/dbraw/zinc/66/61/36/381666136.db2.gz IBBKUWWFAACTIC-PKYBCLHXSA-N 2 0 289.379 2.586 20 5 CFBDRP CC(C)c1ccc(C[NH2+][C@@H](C)C[C@H](C)[NH3+])cc1[N+](=O)[O-] ZINC000575180804 382730093 /nfs/dbraw/zinc/73/00/93/382730093.db2.gz DDVKAOKKFOVHLZ-RYUDHWBXSA-N 2 0 279.384 2.934 20 5 CFBDRP C[C@H](CCCC[NH3+])[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000423049852 383031587 /nfs/dbraw/zinc/03/15/87/383031587.db2.gz YCYUCPRCDYZTEF-LLVKDONJSA-N 2 0 299.802 2.898 20 5 CFBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC(C)(C)[NH3+] ZINC000423289320 383056748 /nfs/dbraw/zinc/05/67/48/383056748.db2.gz WTGZGPSYZJGRQL-NSHDSACASA-N 2 0 297.424 2.792 20 5 CFBDRP Cc1c([C@H](C)[NH2+][C@@H]2CC[NH2+]C[C@H]2C)cccc1[N+](=O)[O-] ZINC000423398896 383081945 /nfs/dbraw/zinc/08/19/45/383081945.db2.gz PEAJBEYLERJWTR-SCDSUCTJSA-N 2 0 277.368 2.552 20 5 CFBDRP C[C@H]([NH2+]C[C@H]1CCC[C@@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000423455970 383101924 /nfs/dbraw/zinc/10/19/24/383101924.db2.gz GHICSZPRPBHCBI-SGMGOOAPSA-N 2 0 277.368 2.763 20 5 CFBDRP C[N@@H+]1CCC[C@@H]2CN(Cc3cccc([N+](=O)[O-])c3)CC[C@H]21 ZINC000248005402 383206132 /nfs/dbraw/zinc/20/61/32/383206132.db2.gz KUEKHMYWLVJCRK-GDBMZVCRSA-N 2 0 289.379 2.511 20 5 CFBDRP C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@@H]([C@H](C)[NH3+])C1 ZINC000251568159 383390768 /nfs/dbraw/zinc/39/07/68/383390768.db2.gz UEVKWQHKJPEGLY-OUCADQQQSA-N 2 0 277.368 2.715 20 5 CFBDRP CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@]1(C)CC[NH2+]C1 ZINC000261871930 383572611 /nfs/dbraw/zinc/57/26/11/383572611.db2.gz PACSQXDTQSFMCH-INIZCTEOSA-N 2 0 291.395 2.805 20 5 CFBDRP C[C@@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[NH2+]1 ZINC000422920625 533379431 /nfs/dbraw/zinc/37/94/31/533379431.db2.gz MJEOXGKTCVNMEE-CJNGLKHVSA-N 2 0 291.395 2.648 20 5 CFBDRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccc([N+](=O)[O-])cc1 ZINC000423538387 394293741 /nfs/dbraw/zinc/29/37/41/394293741.db2.gz GEAJOEAMRAVNIE-CYUUQNCZSA-N 2 0 289.379 2.634 20 5 CFBDRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000044517618 175190647 /nfs/dbraw/zinc/19/06/47/175190647.db2.gz LRSITWMDQQCZMO-ZDUSSCGKSA-N 2 0 291.395 2.977 20 5 CFBDRP C[C@@H](CCC[NH3+])[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000423471710 278227951 /nfs/dbraw/zinc/22/79/51/278227951.db2.gz ZRFDWXNZFQTPIV-XHDPSFHLSA-N 2 0 277.368 2.689 20 5 CFBDRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000423147128 279254731 /nfs/dbraw/zinc/25/47/31/279254731.db2.gz RBRYDRFTECSWHU-NEPJUHHUSA-N 2 0 265.357 2.763 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@H](C[NH3+])C[C@@H]1C ZINC000420319803 281022803 /nfs/dbraw/zinc/02/28/03/281022803.db2.gz POASBYLIXRTGCZ-AVGNSLFASA-N 2 0 277.368 2.633 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1 ZINC000420314343 281022847 /nfs/dbraw/zinc/02/28/47/281022847.db2.gz VOZSHEFNIRAPBG-YXAMBPQSSA-N 2 0 289.379 2.633 20 5 CFBDRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1ccccc1[N+](=O)[O-] ZINC000519564316 281308875 /nfs/dbraw/zinc/30/88/75/281308875.db2.gz WJVCEARTPRKKGH-SDDRHHMPSA-N 2 0 263.341 2.515 20 5 CFBDRP CC(C)c1ccc(C[NH2+][C@H](C)C[C@H](C)[NH3+])cc1[N+](=O)[O-] ZINC000575180803 322720959 /nfs/dbraw/zinc/72/09/59/322720959.db2.gz DDVKAOKKFOVHLZ-NWDGAFQWSA-N 2 0 279.384 2.934 20 5 CFBDRP C[C@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])[C@@H]1CCC[NH2+]C1 ZINC000414855017 533788357 /nfs/dbraw/zinc/78/83/57/533788357.db2.gz MRAXQHZIJQBUMZ-KSLFURFDSA-N 2 0 289.379 2.586 20 5 CFBDRP CC[C@@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000422842960 529203267 /nfs/dbraw/zinc/20/32/67/529203267.db2.gz ZWOZNQVDXAQHNC-UKRRQHHQSA-N 2 0 277.368 2.778 20 5 CFBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC[C@@H](C)[NH+](C)C ZINC000895292518 618514934 /nfs/dbraw/zinc/51/49/34/618514934.db2.gz CXNBLTOJWWELGH-QLKUMGTLSA-N 2 0 291.395 2.928 20 5 CFBDRP C[C@H](CCNC/C=C\c1ccccc1[N+](=O)[O-])[NH+](C)C ZINC000895297778 618516567 /nfs/dbraw/zinc/51/65/67/618516567.db2.gz PDHZKPNYNNJQEG-FWPCIQOSSA-N 2 0 277.368 2.538 20 5 CFBDRP C[C@@H]1C[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C[C@H]1CC[NH3+] ZINC000903977748 621494187 /nfs/dbraw/zinc/49/41/87/621494187.db2.gz YGDLUSZFPDQXNR-ZZEYUXRUSA-N 2 0 289.379 2.525 20 5 CFBDRP CC(C)(C)[C@]1(C[NH3+])CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000866704696 638868098 /nfs/dbraw/zinc/86/80/98/638868098.db2.gz WTZDPGJPBOYKQN-INIZCTEOSA-N 2 0 291.395 2.792 20 5 CFBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCCC[NH+](C)C ZINC000873029772 641988993 /nfs/dbraw/zinc/98/89/93/641988993.db2.gz QKNWHHWJFWWMCD-UHFFFAOYSA-N 2 0 279.384 2.643 20 5 CFBDRP C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)C1CC[NH2+]CC1 ZINC000873222347 642075050 /nfs/dbraw/zinc/07/50/50/642075050.db2.gz OEODVKBEUFWBGP-JTQLQIEISA-N 2 0 297.786 2.726 20 5 CFBDRP CC1(C)C[C@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)c2cc([N+](=O)[O-])ccc21 ZINC000873251101 642098178 /nfs/dbraw/zinc/09/81/78/642098178.db2.gz SXLBRDZQNJUHBJ-RWSFTLGLSA-N 2 0 289.379 2.644 20 5 CFBDRP CCC[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000873258348 642103442 /nfs/dbraw/zinc/10/34/42/642103442.db2.gz OQOSROZKEZAPQJ-UXIGCNINSA-N 2 0 277.368 2.763 20 5 CFBDRP C[C@@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccccc1[N+](=O)[O-] ZINC000873297599 642128777 /nfs/dbraw/zinc/12/87/77/642128777.db2.gz YITYBBZAQICSAM-XJFOESAGSA-N 2 0 289.379 2.634 20 5 CFBDRP C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(CC[NH3+])CC1 ZINC000070183575 346907104 /nfs/dbraw/zinc/90/71/04/346907104.db2.gz CDVUBFUDKOVQBR-GFCCVEGCSA-N 2 0 277.368 2.717 20 5 CFBDRP C[C@@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]1CCC[NH3+] ZINC000595905029 349765589 /nfs/dbraw/zinc/76/55/89/349765589.db2.gz ONLTXEBFXOPOMV-CZUORRHYSA-N 2 0 291.395 2.934 20 5 CFBDRP CC[C@H]([NH2+][C@@H](C)CCC[NH3+])c1cccc([N+](=O)[O-])c1 ZINC000422838995 529649741 /nfs/dbraw/zinc/64/97/41/529649741.db2.gz PKJKISYAYZYGBQ-FZMZJTMJSA-N 2 0 265.357 2.763 20 5 CFBDRP Cc1c([C@@H](C)[NH2+]CC2CC[NH+](C)CC2)cccc1[N+](=O)[O-] ZINC000126282594 187229307 /nfs/dbraw/zinc/22/93/07/187229307.db2.gz ZDRCHXPIDJNQIR-CYBMUJFWSA-N 2 0 291.395 2.896 20 5 CFBDRP C[NH2+]C[C@H](C)[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000596105316 349795700 /nfs/dbraw/zinc/79/57/00/349795700.db2.gz KCDCBAGIJPPXPH-KCQAQPDRSA-N 2 0 291.395 2.504 20 5 CFBDRP C[C@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@H]1CC[NH3+] ZINC000404414444 348591217 /nfs/dbraw/zinc/59/12/17/348591217.db2.gz FIDVPGMXFVWUHJ-WFASDCNBSA-N 2 0 277.368 2.544 20 5 CFBDRP C[C@@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]1CC[NH3+] ZINC000404414440 348591348 /nfs/dbraw/zinc/59/13/48/348591348.db2.gz FIDVPGMXFVWUHJ-IUODEOHRSA-N 2 0 277.368 2.544 20 5 CFBDRP C[C@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]1CC[NH3+] ZINC000404414442 348591548 /nfs/dbraw/zinc/59/15/48/348591548.db2.gz FIDVPGMXFVWUHJ-SWLSCSKDSA-N 2 0 277.368 2.544 20 5 CFBDRP CC[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1cccc([N+](=O)[O-])c1 ZINC000591579270 349031627 /nfs/dbraw/zinc/03/16/27/349031627.db2.gz FMFNJARWDHPLTK-GJZGRUSLSA-N 2 0 289.379 2.778 20 5 CFBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CCC[NH2+]CC1)CCC2 ZINC000591578354 349031639 /nfs/dbraw/zinc/03/16/39/349031639.db2.gz VQQMGEPITTZOQX-XJKSGUPXSA-N 2 0 289.379 2.704 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+][C@@H]2CC23CC[NH2+]CC3)cc1[N+](=O)[O-] ZINC000591579299 349031764 /nfs/dbraw/zinc/03/17/64/349031764.db2.gz HXDNNVMPJJVUOF-IUODEOHRSA-N 2 0 289.379 2.696 20 5 CFBDRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000414170021 233185905 /nfs/dbraw/zinc/18/59/05/233185905.db2.gz BLPUCVHDNPXRRD-UONOGXRCSA-N 2 0 291.395 2.977 20 5 CFBDRP C[NH+]1CCC2(CC[N@H+](Cc3csc([N+](=O)[O-])c3)C2)CC1 ZINC000602875850 351055471 /nfs/dbraw/zinc/05/54/71/351055471.db2.gz BANAHWZNGIIQMW-UHFFFAOYSA-N 2 0 295.408 2.574 20 5 CFBDRP C[N@@H+]1CCC[C@@H]2CN(Cc3csc([N+](=O)[O-])c3)CC[C@@H]21 ZINC000158644998 188387496 /nfs/dbraw/zinc/38/74/96/188387496.db2.gz GXMUOCHMOKOEFY-OLZOCXBDSA-N 2 0 295.408 2.572 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+]CC2CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000297440423 200191307 /nfs/dbraw/zinc/19/13/07/200191307.db2.gz PRVAVZPHFYCHIJ-GFCCVEGCSA-N 2 0 277.368 2.553 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+]CC2(C)CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000423345297 238394121 /nfs/dbraw/zinc/39/41/21/238394121.db2.gz YPYDEMLLHUTDII-CYBMUJFWSA-N 2 0 291.395 2.944 20 5 CFBDRP CC[N@H+](Cc1cccc([N+](=O)[O-])c1C)[C@H]1CCC[NH2+]CC1 ZINC000435613486 240333525 /nfs/dbraw/zinc/33/35/25/240333525.db2.gz KDQWEVOZVJTRPU-HNNXBMFYSA-N 2 0 291.395 2.867 20 5 CFBDRP CC[C@H]([NH2+]C[C@H]1CC[N@H+](CC)C1)c1cccc([N+](=O)[O-])c1 ZINC000037644167 372682086 /nfs/dbraw/zinc/68/20/86/372682086.db2.gz BXRCZWCDZJGMDY-CJNGLKHVSA-N 2 0 291.395 2.977 20 5 CFBDRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1ccc([N+](=O)[O-])cc1 ZINC000045663857 373027263 /nfs/dbraw/zinc/02/72/63/373027263.db2.gz WXXJCFCLRKGTDE-GFCCVEGCSA-N 2 0 265.357 2.587 20 5 CFBDRP [NH3+]CC[C@@H]1CCC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000070171027 374137558 /nfs/dbraw/zinc/13/75/58/374137558.db2.gz HMZGWGASYFMYBO-NSHDSACASA-N 2 0 297.786 2.809 20 5 CFBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@@H]2C1 ZINC000125387822 377150596 /nfs/dbraw/zinc/15/05/96/377150596.db2.gz BMEZGTGZQZLEAC-OSRDXIQISA-N 2 0 289.379 2.715 20 5 CFBDRP CC[NH2+]CC1CC[NH+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000129864089 377484249 /nfs/dbraw/zinc/48/42/49/377484249.db2.gz LDAQZVFGDDTVMZ-ZDUSSCGKSA-N 2 0 291.395 2.977 20 5 CFBDRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000227497381 382837106 /nfs/dbraw/zinc/83/71/06/382837106.db2.gz UMXXZPAZASIXHV-ZDUSSCGKSA-N 2 0 291.395 2.977 20 5 CFBDRP Cc1c([C@@H](C)[NH2+][C@H](C)CCC[NH3+])cccc1[N+](=O)[O-] ZINC000423454558 383102132 /nfs/dbraw/zinc/10/21/32/383102132.db2.gz LRRNUGBUPVYDPS-ZYHUDNBSSA-N 2 0 265.357 2.681 20 5 CFBDRP C[C@@H]1CC2(C[N@@H+]1Cc1csc([N+](=O)[O-])c1)CC[NH2+]CC2 ZINC000424296701 393816519 /nfs/dbraw/zinc/81/65/19/393816519.db2.gz SFROVOQCHDHZEM-LLVKDONJSA-N 2 0 295.408 2.620 20 5 CFBDRP C[NH+](C)CCCC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000278835025 394064535 /nfs/dbraw/zinc/06/45/35/394064535.db2.gz UJLPKOYDBGDGQT-MRXNPFEDSA-N 2 0 291.395 2.904 20 5 CFBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCC[NH+]1CCCC1 ZINC000449224145 394257880 /nfs/dbraw/zinc/25/78/80/394257880.db2.gz ZYQVYAFHJQYOBA-AWEZNQCLSA-N 2 0 291.395 2.601 20 5 CFBDRP C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](CC[NH3+])C1 ZINC000226325117 287144962 /nfs/dbraw/zinc/14/49/62/287144962.db2.gz CKCNDLFOCSCTKZ-STQMWFEESA-N 2 0 277.368 2.717 20 5 CFBDRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000044516229 278341783 /nfs/dbraw/zinc/34/17/83/278341783.db2.gz HIXAAWRJFHOHOX-GFCCVEGCSA-N 2 0 277.368 2.587 20 5 CFBDRP C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1ccc([N+](=O)[O-])cc1 ZINC000423438282 278362672 /nfs/dbraw/zinc/36/26/72/278362672.db2.gz RBRYDRFTECSWHU-NWDGAFQWSA-N 2 0 265.357 2.763 20 5 CFBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@@H]2C1 ZINC000228473012 290251586 /nfs/dbraw/zinc/25/15/86/290251586.db2.gz QTZLMXSNAADVME-WXYCVUISSA-N 2 0 289.379 2.715 20 5 CFBDRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1 ZINC000422949626 533976223 /nfs/dbraw/zinc/97/62/23/533976223.db2.gz UPZRVUZDZAPPMU-OBJOEFQTSA-N 2 0 277.368 2.634 20 5 CFBDRP CC1(C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])CC[NH2+]CC1 ZINC000414909350 527979793 /nfs/dbraw/zinc/97/97/93/527979793.db2.gz RPSGEUUCZOUJNY-GQCTYLIASA-N 2 0 289.379 2.587 20 5 CFBDRP CCC[C@H]([NH2+]CCC[NH2+]C)c1cccc([N+](=O)[O-])c1 ZINC000423201272 528219873 /nfs/dbraw/zinc/21/98/73/528219873.db2.gz OHNQKHSQAUHQAC-AWEZNQCLSA-N 2 0 265.357 2.635 20 5 CFBDRP CCC[C@@H]([NH2+]CCC[NH2+]C)c1cccc([N+](=O)[O-])c1 ZINC000423201273 529007006 /nfs/dbraw/zinc/00/70/06/529007006.db2.gz OHNQKHSQAUHQAC-CQSZACIVSA-N 2 0 265.357 2.635 20 5 CFBDRP C[C@@H]([NH3+])C1CC[NH+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000261968454 617754760 /nfs/dbraw/zinc/75/47/60/617754760.db2.gz QBQAOBXVVJCPNU-SNVBAGLBSA-N 2 0 297.786 2.807 20 5 CFBDRP CC1(C)C[C@@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C[C@@H]([NH3+])C1 ZINC000925628373 618356034 /nfs/dbraw/zinc/35/60/34/618356034.db2.gz DWYDCHXVPOEDJY-KGLIPLIRSA-N 2 0 291.395 2.633 20 5 CFBDRP Cc1c(C[NH2+][C@@H]2C[C@H]([NH3+])CC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000925659468 618421889 /nfs/dbraw/zinc/42/18/89/618421889.db2.gz VAUHCRJETYFPKX-UONOGXRCSA-N 2 0 291.395 2.899 20 5 CFBDRP C[C@H](CCNC/C=C/c1ccccc1[N+](=O)[O-])[NH+](C)C ZINC000895297779 618516788 /nfs/dbraw/zinc/51/67/88/618516788.db2.gz PDHZKPNYNNJQEG-STMXVASLSA-N 2 0 277.368 2.538 20 5 CFBDRP C[C@H](C[NH2+][C@@H]1CCCCC[C@@H]1[NH3+])c1ccccc1[N+](=O)[O-] ZINC000902430070 621076768 /nfs/dbraw/zinc/07/67/68/621076768.db2.gz OAXLHTRSNKDHGR-VHDGCEQUSA-N 2 0 291.395 2.948 20 5 CFBDRP [NH3+][C@@H]1CC[C@H](C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)C1 ZINC000903455093 621388288 /nfs/dbraw/zinc/38/82/88/621388288.db2.gz PUTDUGKLWCVVMT-UONOGXRCSA-N 2 0 289.379 2.687 20 5 CFBDRP CC(C)(C[NH3+])C1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000903789123 621442479 /nfs/dbraw/zinc/44/24/79/621442479.db2.gz OWTPOTAQIFQAKH-UHFFFAOYSA-N 2 0 291.395 2.792 20 5 CFBDRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000903975148 621493179 /nfs/dbraw/zinc/49/31/79/621493179.db2.gz YJBBNEJLDAPILM-GHMZBOCLSA-N 2 0 297.786 2.583 20 5 CFBDRP [NH3+]CC[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000070171164 625279567 /nfs/dbraw/zinc/27/95/67/625279567.db2.gz PKGODBUSCRUNMU-LLVKDONJSA-N 2 0 297.786 2.809 20 5 CFBDRP C[C@@H]1C[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC[C@@H]1C[NH3+] ZINC000923496423 626476435 /nfs/dbraw/zinc/47/64/35/626476435.db2.gz IDZHDERHMCPFTB-GHMZBOCLSA-N 2 0 297.786 2.665 20 5 CFBDRP C[C@H]1C[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CC[C@H]1C[NH3+] ZINC000923499742 626477376 /nfs/dbraw/zinc/47/73/76/626477376.db2.gz SXNIDBYBPLCHAZ-QWRGUYRKSA-N 2 0 297.786 2.665 20 5 CFBDRP C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])C1CCC([NH3+])CC1 ZINC000843055888 631818947 /nfs/dbraw/zinc/81/89/47/631818947.db2.gz RGVHROYBHUZDLS-GQCTYLIASA-N 2 0 289.379 2.810 20 5 CFBDRP [NH3+]C1CCC([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000843105175 631836885 /nfs/dbraw/zinc/83/68/85/631836885.db2.gz RLUZESLDYPLFNS-UHFFFAOYSA-N 2 0 283.759 2.608 20 5 CFBDRP [NH3+]CC[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000843113625 631838608 /nfs/dbraw/zinc/83/86/08/631838608.db2.gz ZOKOGERWIZTVNH-NSHDSACASA-N 2 0 297.786 2.809 20 5 CFBDRP C[C@H]([NH2+]CCCC[NH+](C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872030148 641561009 /nfs/dbraw/zinc/56/10/09/641561009.db2.gz ZWXWWRNWHCBWFE-NSHDSACASA-N 2 0 283.347 2.726 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+][C@H](C)C2CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000873265605 642109082 /nfs/dbraw/zinc/10/90/82/642109082.db2.gz OQTLHHNVXDSPAK-CHWSQXEVSA-N 2 0 291.395 2.942 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@H]([NH3+])C23CCC3)cc1[N+](=O)[O-] ZINC000925575919 648224205 /nfs/dbraw/zinc/22/42/05/648224205.db2.gz JANGULHTTMMWEG-TUKIKUTGSA-N 2 0 289.379 2.824 20 5 CFBDRP C[C@@H]([NH3+])[C@H](NCCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000925631705 648251084 /nfs/dbraw/zinc/25/10/84/648251084.db2.gz WRUIRXFTHLNMKG-DYVFJYSZSA-N 2 0 299.374 2.815 20 5 CFBDRP CC[N+](C)(C)Cc1ccccc1-n1cccc1C[NH3+] ZINC001167593343 770955225 /nfs/dbraw/zinc/95/52/25/770955225.db2.gz RXRKQUPQGXNYPO-UHFFFAOYSA-N 2 0 258.389 2.532 20 5 CFBDRP CC(C)[N@H+]1[C@@H]2CC[C@H]1C[C@@H](OCCC[N+](C)(C)C)C2 ZINC001224620810 778603252 /nfs/dbraw/zinc/60/32/52/778603252.db2.gz BYFDBRHDZPXTMZ-ZSHCYNCHSA-N 2 0 269.453 2.503 20 5 CFBDRP CC[N+](C)(C)Cc1ccccc1N[C@H](C)C[NH+](C)C ZINC001163776605 781570796 /nfs/dbraw/zinc/57/07/96/781570796.db2.gz FJJQCJBNSSTLLT-CQSZACIVSA-N 2 0 264.437 2.645 20 5 CFBDRP C[NH2+]C[C@@H](C)CNc1cc(C)[nH+]c2ccc([N+](=O)[O-])cc12 ZINC000122235807 529986280 /nfs/dbraw/zinc/98/62/80/529986280.db2.gz JWDWFXVEWABCII-SNVBAGLBSA-N 2 0 288.351 2.719 20 5 CFBDRP C[C@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H]1CC[NH3+] ZINC000404411545 348591352 /nfs/dbraw/zinc/59/13/52/348591352.db2.gz XWRFMUQMCUNIAL-XJKSGUPXSA-N 2 0 291.395 2.587 20 5 CFBDRP Cc1ccc(C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])cc1[N+](=O)[O-] ZINC000414792756 233353057 /nfs/dbraw/zinc/35/30/57/233353057.db2.gz CUDONAIGTPKWSS-ZIAGYGMSSA-N 2 0 277.368 2.510 20 5 CFBDRP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])cc1 ZINC000414809360 233361656 /nfs/dbraw/zinc/36/16/56/233361656.db2.gz MHUZFFSPYYVLTH-LBPRGKRZSA-N 2 0 285.347 2.904 20 5 CFBDRP Cc1cc(NCCCC[NH3+])c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000122164838 187018833 /nfs/dbraw/zinc/01/88/33/187018833.db2.gz BHGCLGWFDAZGNW-UHFFFAOYSA-N 2 0 274.324 2.602 20 5 CFBDRP C[C@@H]1C[C@H](C)N(Cc2c(F)cccc2[N+](=O)[O-])C[C@@H]1C[NH3+] ZINC000422638174 237119472 /nfs/dbraw/zinc/11/94/72/237119472.db2.gz PWEXRBGBAVRGCR-WOPDTQHZSA-N 2 0 295.358 2.539 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000422917114 237344622 /nfs/dbraw/zinc/34/46/22/237344622.db2.gz CMVBFJBYMQCWDA-GXTWGEPZSA-N 2 0 277.368 2.696 20 5 CFBDRP Cc1c([C@H](C)[NH2+]C[C@]2(C)CCC[NH2+]C2)cccc1[N+](=O)[O-] ZINC000423346303 238395656 /nfs/dbraw/zinc/39/56/56/238395656.db2.gz ZSJZEHACFUJNJU-XJKSGUPXSA-N 2 0 291.395 2.944 20 5 CFBDRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)c1cccc([N+](=O)[O-])c1 ZINC000051693096 373405730 /nfs/dbraw/zinc/40/57/30/373405730.db2.gz CALMWESRHMPQGF-QFWMXSHPSA-N 2 0 263.341 2.515 20 5 CFBDRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000332298308 378744309 /nfs/dbraw/zinc/74/43/09/378744309.db2.gz MRCZVQULAYPHIM-DVOMOZLQSA-N 2 0 289.379 2.832 20 5 CFBDRP O=[N+]([O-])c1cccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)c1 ZINC000278525616 194028043 /nfs/dbraw/zinc/02/80/43/194028043.db2.gz TULPNUKHMHXYRP-UHFFFAOYSA-N 2 0 289.379 2.559 20 5 CFBDRP CN(CC[C@@H]1CCCC[N@@H+]1C)Cc1ccccc1[N+](=O)[O-] ZINC000173961243 379806247 /nfs/dbraw/zinc/80/62/47/379806247.db2.gz WSYYGZRZQNFSCY-HNNXBMFYSA-N 2 0 291.395 2.901 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[NH2+]C[C@H]1C ZINC000414948404 381638033 /nfs/dbraw/zinc/63/80/33/381638033.db2.gz XZKJENZXVYEUOR-UMVBOHGHSA-N 2 0 291.395 2.504 20 5 CFBDRP Cc1ccc(C[NH2+]CCC[C@H]2CCC[NH2+]2)cc1[N+](=O)[O-] ZINC000414971017 381667369 /nfs/dbraw/zinc/66/73/69/381667369.db2.gz LAZMAJXCGNRWEL-AWEZNQCLSA-N 2 0 277.368 2.525 20 5 CFBDRP C[C@@H](CCCC[NH3+])[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000415016898 381711385 /nfs/dbraw/zinc/71/13/85/381711385.db2.gz QOLVYFUSJIEHMA-XURPKSDJSA-N 2 0 277.368 2.715 20 5 CFBDRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000423047049 383028773 /nfs/dbraw/zinc/02/87/73/383028773.db2.gz UOHXDLLIKHKGOZ-UWVGGRQHSA-N 2 0 285.775 2.506 20 5 CFBDRP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cccc([N+](=O)[O-])c1 ZINC000423479636 383113195 /nfs/dbraw/zinc/11/31/95/383113195.db2.gz MIFAAYYDDCEWAM-OCCSQVGLSA-N 2 0 277.368 2.778 20 5 CFBDRP O=[N+]([O-])c1ccccc1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000339498367 383217166 /nfs/dbraw/zinc/21/71/66/383217166.db2.gz LTGYIHFGZTULTQ-UHFFFAOYSA-N 2 0 291.395 2.951 20 5 CFBDRP C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H]([C@H](C)[NH3+])C1 ZINC000251267900 383387086 /nfs/dbraw/zinc/38/70/86/383387086.db2.gz NGJYSKKUTIHDSJ-XQQFMLRXSA-N 2 0 277.368 2.715 20 5 CFBDRP C[NH2+]CCC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000261609785 383527988 /nfs/dbraw/zinc/52/79/88/383527988.db2.gz DQHNBNZOVSEKIK-UHFFFAOYSA-N 2 0 295.358 2.555 20 5 CFBDRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000249370158 131120789 /nfs/dbraw/zinc/12/07/89/131120789.db2.gz ADUDLOGLTKLQOT-ZIAGYGMSSA-N 2 0 291.395 2.896 20 5 CFBDRP C[NH+](C)C1CCC([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000421375935 394208586 /nfs/dbraw/zinc/20/85/86/394208586.db2.gz QSUVNJYSESCKMV-UHFFFAOYSA-N 2 0 295.358 2.696 20 5 CFBDRP C[C@H](N[C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000156581269 394335830 /nfs/dbraw/zinc/33/58/30/394335830.db2.gz NSWIAUXZTRSCDL-SGMGOOAPSA-N 2 0 277.368 2.728 20 5 CFBDRP Cc1c([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C)C2)cccc1[N+](=O)[O-] ZINC000158176160 394355325 /nfs/dbraw/zinc/35/53/25/394355325.db2.gz GCAJITAUAGNHOW-UONOGXRCSA-N 2 0 291.395 2.896 20 5 CFBDRP C[C@@H]1C[C@H]([NH2+]C/C=C\c2ccccc2[N+](=O)[O-])CC[N@@H+]1C ZINC000344610617 162081103 /nfs/dbraw/zinc/08/11/03/162081103.db2.gz AXBHVKDFBWOWQC-BBUPELFUSA-N 2 0 289.379 2.680 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+]CC2CC[NH+](C)CC2)cc1[N+](=O)[O-] ZINC000044515998 175190187 /nfs/dbraw/zinc/19/01/87/175190187.db2.gz USDXBIRVFGEMCT-CYBMUJFWSA-N 2 0 291.395 2.896 20 5 CFBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000314656485 265172927 /nfs/dbraw/zinc/17/29/27/265172927.db2.gz BCEPCHSSILQAIF-YUELXQCFSA-N 2 0 289.379 2.587 20 5 CFBDRP C[NH+]1CCC2(CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000374321983 277038460 /nfs/dbraw/zinc/03/84/60/277038460.db2.gz BKJIHRCZIAPNQJ-UHFFFAOYSA-N 2 0 289.379 2.655 20 5 CFBDRP C[NH2+]C[C@@H](C)C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000423275177 277274964 /nfs/dbraw/zinc/27/49/64/277274964.db2.gz MTRXLBSXCMWVIR-ABAIWWIYSA-N 2 0 291.395 2.762 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000415039364 289505787 /nfs/dbraw/zinc/50/57/87/289505787.db2.gz NYEYGIPEAXAIMD-UMVBOHGHSA-N 2 0 291.395 2.633 20 5 CFBDRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccc([N+](=O)[O-])cc1 ZINC000423538394 290024939 /nfs/dbraw/zinc/02/49/39/290024939.db2.gz GEAJOEAMRAVNIE-ZGKBOVNRSA-N 2 0 289.379 2.634 20 5 CFBDRP CC(C)[NH2+]CCC[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000564823250 290236727 /nfs/dbraw/zinc/23/67/27/290236727.db2.gz XMWSFQXQQQRSDS-AWEZNQCLSA-N 2 0 293.411 2.894 20 5 CFBDRP Cc1c([C@@H](C)[NH2+]C[C@@H]2CCC[NH2+]C2)cccc1[N+](=O)[O-] ZINC000423211350 533943156 /nfs/dbraw/zinc/94/31/56/533943156.db2.gz KZCFVOHJEPHWGB-CHWSQXEVSA-N 2 0 277.368 2.553 20 5 CFBDRP C[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)CC1CC[NH+](C)CC1 ZINC000313977236 523272285 /nfs/dbraw/zinc/27/22/85/523272285.db2.gz VDNSIVWTIJFUKS-UHFFFAOYSA-N 2 0 295.358 2.508 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+]C2CCC([NH3+])CC2)cc1[N+](=O)[O-] ZINC000051693114 525915460 /nfs/dbraw/zinc/91/54/60/525915460.db2.gz LCVCELKRIYOSPT-XGNXJENSSA-N 2 0 277.368 2.824 20 5 CFBDRP CC(C)c1ccc(C[NH2+][C@H](C)CC[NH3+])cc1[N+](=O)[O-] ZINC000414890117 528099891 /nfs/dbraw/zinc/09/98/91/528099891.db2.gz TYGKLLAIWMWJIX-LLVKDONJSA-N 2 0 265.357 2.545 20 5 CFBDRP CCOc1ccc([C@@H](C)[NH2+][C@@H](C)CCC[NH3+])cc1[N+](=O)[O-] ZINC000423467320 528596551 /nfs/dbraw/zinc/59/65/51/528596551.db2.gz XKNBOEHXCMGZNT-NWDGAFQWSA-N 2 0 295.383 2.772 20 5 CFBDRP CCC([NH3+])(CC)C[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000423291125 528949752 /nfs/dbraw/zinc/94/97/52/528949752.db2.gz GWZZQXVHKOSKFL-LBPRGKRZSA-N 2 0 279.384 2.633 20 5 CFBDRP C[C@@H](CCCC[NH3+])[NH2+]C[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000902429410 621076633 /nfs/dbraw/zinc/07/66/33/621076633.db2.gz KZZRHJRJOYFUNQ-OLZOCXBDSA-N 2 0 279.384 2.805 20 5 CFBDRP C[C@H](C[NH2+][C@@H]1C[C@H]([NH3+])C12CCC2)c1ccccc1[N+](=O)[O-] ZINC000902431615 621077898 /nfs/dbraw/zinc/07/78/98/621077898.db2.gz SZXXWKIYJKSQHP-BYCMXARLSA-N 2 0 289.379 2.558 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000903498282 621394102 /nfs/dbraw/zinc/39/41/02/621394102.db2.gz BUTXPTPIQWAWPR-HZSPNIEDSA-N 2 0 291.395 2.881 20 5 CFBDRP C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C[C@H]1CC[NH3+] ZINC000903978727 621494209 /nfs/dbraw/zinc/49/42/09/621494209.db2.gz VUMCCDZFFFWWQO-ZYHUDNBSSA-N 2 0 297.786 2.665 20 5 CFBDRP C[C@@H]1C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C[C@H]1CC[NH3+] ZINC000903977746 621494467 /nfs/dbraw/zinc/49/44/67/621494467.db2.gz YGDLUSZFPDQXNR-AVXNYWLKSA-N 2 0 289.379 2.525 20 5 CFBDRP C[C@H]([NH2+]C[C@H]1CC[NH2+][C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000903987441 621499559 /nfs/dbraw/zinc/49/95/59/621499559.db2.gz GJCJZAANJZVCRM-AGIUHOORSA-N 2 0 277.368 2.634 20 5 CFBDRP C[C@@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1ccc([N+](=O)[O-])cc1 ZINC000903987552 621499580 /nfs/dbraw/zinc/49/95/80/621499580.db2.gz GUICYSDYIZOIET-RAIGVLPGSA-N 2 0 263.341 2.515 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@H](CC[NH3+])C1 ZINC000923480476 626475965 /nfs/dbraw/zinc/47/59/65/626475965.db2.gz HKDCPDWQEGZZGW-OLZOCXBDSA-N 2 0 277.368 2.635 20 5 CFBDRP C[C@@H]1C[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC[C@@H]1C[NH3+] ZINC000923499201 626477319 /nfs/dbraw/zinc/47/73/19/626477319.db2.gz RHHBADVGRISYGJ-GHMZBOCLSA-N 2 0 297.786 2.665 20 5 CFBDRP C[NH+](C)CCCC[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783607099 628726232 /nfs/dbraw/zinc/72/62/32/628726232.db2.gz IBVJYEAJSCLWNV-UHFFFAOYSA-N 2 0 285.775 2.680 20 5 CFBDRP C[NH+](C)C1(C)CCC([NH2+]Cc2ccccc2[N+](=O)[O-])CC1 ZINC000865765813 638562039 /nfs/dbraw/zinc/56/20/39/638562039.db2.gz MYGGYKYJVLWEIT-UHFFFAOYSA-N 2 0 291.395 2.947 20 5 CFBDRP C[C@H]([NH3+])[C@H](NCCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000925631706 648250881 /nfs/dbraw/zinc/25/08/81/648250881.db2.gz WRUIRXFTHLNMKG-GUYCJALGSA-N 2 0 299.374 2.815 20 5 CFBDRP CC(C)([NH3+])CC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000925737781 648304870 /nfs/dbraw/zinc/30/48/70/648304870.db2.gz LDYJSGZIUVBFQQ-AWEZNQCLSA-N 2 0 277.368 2.689 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+]CCC(C)(C)[NH3+])cc1[N+](=O)[O-] ZINC000925739870 648305564 /nfs/dbraw/zinc/30/55/64/648305564.db2.gz ANNLUCONMOLFMG-LLVKDONJSA-N 2 0 265.357 2.681 20 5 CFBDRP C[NH+](C)CC[C@@H](OCCC[N+](C)(C)C)c1ccccc1 ZINC001224620827 775228547 /nfs/dbraw/zinc/22/85/47/775228547.db2.gz CHOYATLZQBEPDS-QGZVFWFLSA-N 2 0 279.448 2.792 20 5 CFBDRP C[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H]1CC[NH3+] ZINC000404444380 348592029 /nfs/dbraw/zinc/59/20/29/348592029.db2.gz WJUJHJLWKXZCNN-SWLSCSKDSA-N 2 0 277.368 2.544 20 5 CFBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC[NH2+]CC1 ZINC000591278457 349006486 /nfs/dbraw/zinc/00/64/86/349006486.db2.gz DLXZKNKBVZPGON-ZFWWWQNUSA-N 2 0 291.395 2.648 20 5 CFBDRP Cc1c([C@@H](C)[NH2+][C@H]2CCC[NH2+]CC2)cccc1[N+](=O)[O-] ZINC000591578240 349032180 /nfs/dbraw/zinc/03/21/80/349032180.db2.gz DVUVURYFOYLHHC-OLZOCXBDSA-N 2 0 277.368 2.696 20 5 CFBDRP [NH3+]CC1(CC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000593321026 349246603 /nfs/dbraw/zinc/24/66/03/349246603.db2.gz WPKLNZSFURUGNX-OAHLLOKOSA-N 2 0 289.379 2.691 20 5 CFBDRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000414793847 233352906 /nfs/dbraw/zinc/35/29/06/233352906.db2.gz FDXKEALAZSWEQP-QKNOVVFDSA-N 2 0 289.379 2.715 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000414826861 233367845 /nfs/dbraw/zinc/36/78/45/233367845.db2.gz GISKACJVPDGZHT-KGLIPLIRSA-N 2 0 291.395 2.505 20 5 CFBDRP C[C@@]1(C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])CCC[NH2+]C1 ZINC000414913814 233397709 /nfs/dbraw/zinc/39/77/09/233397709.db2.gz WYBLLWGKGXWVNY-OUOZUETKSA-N 2 0 289.379 2.587 20 5 CFBDRP C[N@@H+]1CC[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1(C)C ZINC000598962732 350349538 /nfs/dbraw/zinc/34/95/38/350349538.db2.gz IQSZMKXXAHOXNH-CQSZACIVSA-N 2 0 291.395 2.600 20 5 CFBDRP C[C@H](NC[C@H]1CCCC[N@H+](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000599070035 350370218 /nfs/dbraw/zinc/37/02/18/350370218.db2.gz JOZKRORIJBJQFN-UONOGXRCSA-N 2 0 291.395 2.977 20 5 CFBDRP C[N@H+]1CC=C(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000271868298 191378497 /nfs/dbraw/zinc/37/84/97/191378497.db2.gz WYWGICGVTGNERR-UHFFFAOYSA-N 2 0 295.770 2.600 20 5 CFBDRP [NH3+][C@@H]1C[C@H]([NH2+]CCc2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000422778563 237196811 /nfs/dbraw/zinc/19/68/11/237196811.db2.gz ASMWFIKXXCVFNM-CVEARBPZSA-N 2 0 297.358 2.872 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@H]2CCC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000422917115 237345051 /nfs/dbraw/zinc/34/50/51/237345051.db2.gz CMVBFJBYMQCWDA-JSGCOSHPSA-N 2 0 277.368 2.696 20 5 CFBDRP Cc1c([C@H](C)[NH2+]C2CCC([NH3+])CC2)cccc1[N+](=O)[O-] ZINC000423210347 238279461 /nfs/dbraw/zinc/27/94/61/238279461.db2.gz FTTKTJDUCGFUCM-HIFPTAJRSA-N 2 0 277.368 2.824 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+]C[C@]2(C)CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000423332183 238382498 /nfs/dbraw/zinc/38/24/98/238382498.db2.gz PBRGXDLFFUQGLM-CZUORRHYSA-N 2 0 291.395 2.944 20 5 CFBDRP C[N@@H+]1CCC[C@@H](CC[NH2+]Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000459734910 245293196 /nfs/dbraw/zinc/29/31/96/245293196.db2.gz OWHCCNVVRBBDEK-LBPRGKRZSA-N 2 0 295.358 2.555 20 5 CFBDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000037644300 372681484 /nfs/dbraw/zinc/68/14/84/372681484.db2.gz UAIZWNOYVZCUQP-STQMWFEESA-N 2 0 277.368 2.587 20 5 CFBDRP C[NH+](C)CCCC[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000045663878 373026907 /nfs/dbraw/zinc/02/69/07/373026907.db2.gz NYEFIQKGHVDNJN-UHFFFAOYSA-N 2 0 285.775 2.680 20 5 CFBDRP C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](CC[NH3+])C1 ZINC000070169444 374134981 /nfs/dbraw/zinc/13/49/81/374134981.db2.gz CKCNDLFOCSCTKZ-QWHCGFSZSA-N 2 0 277.368 2.717 20 5 CFBDRP O=[N+]([O-])c1ccccc1/C=C/C[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000414967117 381663857 /nfs/dbraw/zinc/66/38/57/381663857.db2.gz GVUSMNKBVFLGAO-NKPGBKMFSA-N 2 0 289.379 2.730 20 5 CFBDRP [NH3+][C@@H]1CCC[C@@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000414995494 381686763 /nfs/dbraw/zinc/68/67/63/381686763.db2.gz FTPBRWHZEWHHMY-ZYHUDNBSSA-N 2 0 297.786 2.855 20 5 CFBDRP CC(C)c1ccc(C[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)cc1[N+](=O)[O-] ZINC000415047306 381734534 /nfs/dbraw/zinc/73/45/34/381734534.db2.gz VQOKELMVWBHSFT-TZMCWYRMSA-N 2 0 291.395 2.935 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC[NH2+]C1CC1 ZINC000415066469 381751979 /nfs/dbraw/zinc/75/19/79/381751979.db2.gz ITQSVBAAXVNXPC-CYBMUJFWSA-N 2 0 291.395 2.648 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+]CC[C@H]2CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000420413195 382402952 /nfs/dbraw/zinc/40/29/52/382402952.db2.gz SUKSLOVHDBACMD-ZIAGYGMSSA-N 2 0 291.395 2.944 20 5 CFBDRP [NH3+][C@H]1CCC[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000577650211 382866647 /nfs/dbraw/zinc/86/66/47/382866647.db2.gz IDSFFUZRYOPVBU-QWHCGFSZSA-N 2 0 297.786 2.650 20 5 CFBDRP C[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1ccc([N+](=O)[O-])cc1 ZINC000423260835 383054250 /nfs/dbraw/zinc/05/42/50/383054250.db2.gz QVZLNLXRCLBOGG-STQMWFEESA-N 2 0 277.368 2.635 20 5 CFBDRP Cc1c([C@H](C)[NH2+][C@@H]2CCC[C@H]([NH3+])C2)cccc1[N+](=O)[O-] ZINC000423363781 383065093 /nfs/dbraw/zinc/06/50/93/383065093.db2.gz AKRHOXPSZPHHIJ-RWMBFGLXSA-N 2 0 277.368 2.824 20 5 CFBDRP CC(C)[N@H+](C)CCC[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449072694 383162229 /nfs/dbraw/zinc/16/22/29/383162229.db2.gz KVNREPHPBFOTOE-AWEZNQCLSA-N 2 0 293.411 2.846 20 5 CFBDRP C[NH+]1CCC(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])CC1 ZINC000570941950 383649901 /nfs/dbraw/zinc/64/99/01/383649901.db2.gz SGGZMIXBGOTJGO-OAHLLOKOSA-N 2 0 289.379 2.514 20 5 CFBDRP C[N@H+](CCCC[NH2+]Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000453601761 383868572 /nfs/dbraw/zinc/86/85/72/383868572.db2.gz VNTNLLYCTPBRTO-UHFFFAOYSA-N 2 0 277.368 2.559 20 5 CFBDRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000423344326 533355811 /nfs/dbraw/zinc/35/58/11/533355811.db2.gz XQGCSKGMNNPDIR-GFCCVEGCSA-N 2 0 277.368 2.635 20 5 CFBDRP C[C@H]([NH3+])CC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000423222225 274502990 /nfs/dbraw/zinc/50/29/90/274502990.db2.gz AHOWHYURJJSLRZ-IINYFYTJSA-N 2 0 277.368 2.644 20 5 CFBDRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000423016571 279255050 /nfs/dbraw/zinc/25/50/50/279255050.db2.gz MYALXPQGSSRLGQ-VXGBXAGGSA-N 2 0 265.357 2.763 20 5 CFBDRP C[C@H](CCC[NH3+])[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000422925472 533867630 /nfs/dbraw/zinc/86/76/30/533867630.db2.gz VIWZXFJCQMDGRY-CYBMUJFWSA-N 2 0 279.384 2.635 20 5 CFBDRP Cc1ccc(C[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)cc1[N+](=O)[O-] ZINC000415027469 534067573 /nfs/dbraw/zinc/06/75/73/534067573.db2.gz WLZLNZIAONJMQV-HDJSIYSDSA-N 2 0 291.395 2.758 20 5 CFBDRP C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1cccc([N+](=O)[O-])c1 ZINC000336817568 525593963 /nfs/dbraw/zinc/59/39/63/525593963.db2.gz QWIVQKQDLRLAHW-NWDGAFQWSA-N 2 0 265.357 2.763 20 5 CFBDRP C[N@@H+]1CCC[C@H](CC[NH2+]Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000459734907 536384657 /nfs/dbraw/zinc/38/46/57/536384657.db2.gz OWHCCNVVRBBDEK-GFCCVEGCSA-N 2 0 295.358 2.555 20 5 CFBDRP CCC[C@H]([NH2+][C@H]1C[C@H](C[NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000902486774 621112119 /nfs/dbraw/zinc/11/21/19/621112119.db2.gz BPCCFPQMMCULLX-WHOFXGATSA-N 2 0 277.368 2.763 20 5 CFBDRP O=[N+]([O-])c1ccccc1C[NH2+]Cc1cccc2c1CC[NH2+]C2 ZINC000903923008 621474559 /nfs/dbraw/zinc/47/45/59/621474559.db2.gz JGKZCNOAITYNGH-UHFFFAOYSA-N 2 0 297.358 2.530 20 5 CFBDRP C[C@@H]1C[NH2+]C[C@H]1CC[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000903975129 621492746 /nfs/dbraw/zinc/49/27/46/621492746.db2.gz XSIQFUNYIFGTNF-GHMZBOCLSA-N 2 0 297.786 2.583 20 5 CFBDRP C[C@@H]1C[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])CC[C@@H]1C[NH3+] ZINC000904410709 621591856 /nfs/dbraw/zinc/59/18/56/621591856.db2.gz FTONZDSFZHNKIM-ZZEYUXRUSA-N 2 0 289.379 2.525 20 5 CFBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C[NH3+])[C@H](C)C1 ZINC000923497911 626477200 /nfs/dbraw/zinc/47/72/00/626477200.db2.gz NEURJZRHJWDHIF-AGIUHOORSA-N 2 0 277.368 2.573 20 5 CFBDRP [NH3+]C1CCC([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000843105263 631836483 /nfs/dbraw/zinc/83/64/83/631836483.db2.gz SQINWYLQTPUAHN-UHFFFAOYSA-N 2 0 283.759 2.608 20 5 CFBDRP Cc1ccc(C[NH2+]CCCCCC[NH3+])cc1[N+](=O)[O-] ZINC000843127175 631846402 /nfs/dbraw/zinc/84/64/02/631846402.db2.gz AJBJXZBZCSCNRO-UHFFFAOYSA-N 2 0 265.357 2.512 20 5 CFBDRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872035219 641567056 /nfs/dbraw/zinc/56/70/56/641567056.db2.gz UGCJOERRVAKKCE-NSHDSACASA-N 2 0 295.358 2.726 20 5 CFBDRP CC1(C)C[C@@H]([NH3+])C[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000925492468 648181999 /nfs/dbraw/zinc/18/19/99/648181999.db2.gz IULWTGHGORXMNO-KBPBESRZSA-N 2 0 291.395 2.633 20 5 CFBDRP C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000723887143 770706936 /nfs/dbraw/zinc/70/69/36/770706936.db2.gz KZGWIFULBJMLBL-MBNYWOFBSA-N 2 0 277.368 2.573 20 5 CFBDRP C[N+](C)(C)CCCO[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001224619142 775227615 /nfs/dbraw/zinc/22/76/15/775227615.db2.gz MDPHOWTUIMNLQB-SFHVURJKSA-N 2 0 291.459 2.764 20 5 CFBDRP Cc1c([C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)cccc1[N+](=O)[O-] ZINC000594510876 349435543 /nfs/dbraw/zinc/43/55/43/349435543.db2.gz PIEMCQCDMFPVBQ-MCIONIFRSA-N 2 0 291.395 2.894 20 5 CFBDRP Cc1ccc(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])cc1[N+](=O)[O-] ZINC000414792754 233353935 /nfs/dbraw/zinc/35/39/35/233353935.db2.gz CUDONAIGTPKWSS-KGLIPLIRSA-N 2 0 277.368 2.510 20 5 CFBDRP Cc1ccc(C[NH2+][C@H]2CCCC[C@H]2C[NH3+])cc1[N+](=O)[O-] ZINC000414792753 233353986 /nfs/dbraw/zinc/35/39/86/233353986.db2.gz CUDONAIGTPKWSS-KBPBESRZSA-N 2 0 277.368 2.510 20 5 CFBDRP Cc1ccc(CNC[C@H]2CCCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000598994052 350356696 /nfs/dbraw/zinc/35/66/96/350356696.db2.gz GIAXBURSPCURFS-OAHLLOKOSA-N 2 0 291.395 2.725 20 5 CFBDRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1cccc([N+](=O)[O-])c1 ZINC000602022773 350833747 /nfs/dbraw/zinc/83/37/47/350833747.db2.gz VBTBPWYTKBLPBK-OBJOEFQTSA-N 2 0 277.368 2.763 20 5 CFBDRP C[C@@H]1C[C@@H](C)N(Cc2c(F)cccc2[N+](=O)[O-])C[C@@H]1C[NH3+] ZINC000422638173 237119519 /nfs/dbraw/zinc/11/95/19/237119519.db2.gz PWEXRBGBAVRGCR-UTUOFQBUSA-N 2 0 295.358 2.539 20 5 CFBDRP CC[C@@H]([NH2+]CC1CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000297458033 200197464 /nfs/dbraw/zinc/19/74/64/200197464.db2.gz QRGOXNCHKORIFO-OAHLLOKOSA-N 2 0 277.368 2.635 20 5 CFBDRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000423513818 283485454 /nfs/dbraw/zinc/48/54/54/283485454.db2.gz RONNBCIIBFATLX-FFSVYQOJSA-N 2 0 289.379 2.689 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+]C[C@@]2(C)CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000423332181 238383717 /nfs/dbraw/zinc/38/37/17/238383717.db2.gz PBRGXDLFFUQGLM-CJNGLKHVSA-N 2 0 291.395 2.944 20 5 CFBDRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000423344327 238392414 /nfs/dbraw/zinc/39/24/14/238392414.db2.gz XQGCSKGMNNPDIR-LBPRGKRZSA-N 2 0 277.368 2.635 20 5 CFBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)CCCC[NH3+] ZINC000423438662 238458753 /nfs/dbraw/zinc/45/87/53/238458753.db2.gz ROYVXBNNJBQXIW-QWHCGFSZSA-N 2 0 279.384 2.633 20 5 CFBDRP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)c1cccc([N+](=O)[O-])c1 ZINC000037644166 372680555 /nfs/dbraw/zinc/68/05/55/372680555.db2.gz BXRCZWCDZJGMDY-XJKSGUPXSA-N 2 0 291.395 2.977 20 5 CFBDRP C[NH2+]CC1CC[NH+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000063158888 373789278 /nfs/dbraw/zinc/78/92/78/373789278.db2.gz YHNWWSHGKNKAFF-LBPRGKRZSA-N 2 0 277.368 2.587 20 5 CFBDRP O=[N+]([O-])c1ccc(C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)cc1 ZINC000063197927 373795026 /nfs/dbraw/zinc/79/50/26/373795026.db2.gz RXFGMESGBHXEDW-INIZCTEOSA-N 2 0 289.379 2.559 20 5 CFBDRP Cc1c(CN(C)CC[C@H]([NH3+])C(C)C)cccc1[N+](=O)[O-] ZINC000128482375 377340886 /nfs/dbraw/zinc/34/08/86/377340886.db2.gz UKIKTYNNFCPQDO-AWEZNQCLSA-N 2 0 279.384 2.708 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000415039363 381728542 /nfs/dbraw/zinc/72/85/42/381728542.db2.gz NYEYGIPEAXAIMD-NFAWXSAZSA-N 2 0 291.395 2.633 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+]CC2=CC[N@H+](C)CC2)cc1[N+](=O)[O-] ZINC000344293789 382256726 /nfs/dbraw/zinc/25/67/26/382256726.db2.gz RBTXMDUEIUPCBL-ZDUSSCGKSA-N 2 0 289.379 2.816 20 5 CFBDRP CC(C)[N@H+](CC[C@@H]1CC[NH2+]C1)Cc1ccc([N+](=O)[O-])cc1 ZINC000420297759 382349655 /nfs/dbraw/zinc/34/96/55/382349655.db2.gz DLQRSNURDCAYKR-AWEZNQCLSA-N 2 0 291.395 2.805 20 5 CFBDRP O=[N+]([O-])c1ccccc1C[N@H+](CC[C@@H]1CC[NH2+]C1)C1CC1 ZINC000420356250 382380867 /nfs/dbraw/zinc/38/08/67/382380867.db2.gz GJMKDQXMKSBTTO-ZDUSSCGKSA-N 2 0 289.379 2.559 20 5 CFBDRP CC[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1cccc([N+](=O)[O-])c1 ZINC000420397870 382398167 /nfs/dbraw/zinc/39/81/67/382398167.db2.gz GMYYAEPGXBVSSA-WFASDCNBSA-N 2 0 277.368 2.635 20 5 CFBDRP C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CC(C)(C)C[NH3+] ZINC000346693910 382477451 /nfs/dbraw/zinc/47/74/51/382477451.db2.gz QNAYBJHSTOZEKJ-SOFGYWHQSA-N 2 0 277.368 2.525 20 5 CFBDRP [NH3+][C@@H]1CCC[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000577650209 382866564 /nfs/dbraw/zinc/86/65/64/382866564.db2.gz IDSFFUZRYOPVBU-CHWSQXEVSA-N 2 0 297.786 2.650 20 5 CFBDRP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cccc([N+](=O)[O-])c1 ZINC000423479637 383113074 /nfs/dbraw/zinc/11/30/74/383113074.db2.gz MIFAAYYDDCEWAM-TZMCWYRMSA-N 2 0 277.368 2.778 20 5 CFBDRP C[C@H](N[C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000156581498 394335758 /nfs/dbraw/zinc/33/57/58/394335758.db2.gz NSWIAUXZTRSCDL-OBJOEFQTSA-N 2 0 277.368 2.728 20 5 CFBDRP C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]2C[NH2+]C[C@H]2CC1 ZINC000314656478 265174250 /nfs/dbraw/zinc/17/42/50/265174250.db2.gz BCEPCHSSILQAIF-AEGPPILISA-N 2 0 289.379 2.587 20 5 CFBDRP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000037648976 278354744 /nfs/dbraw/zinc/35/47/44/278354744.db2.gz WGFMZHYTQZWONB-CHWSQXEVSA-N 2 0 289.379 2.730 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000126281896 280651094 /nfs/dbraw/zinc/65/10/94/280651094.db2.gz OXJVXYUBXAKFHT-ZDUSSCGKSA-N 2 0 291.395 2.896 20 5 CFBDRP C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C[NH3+])c1ccc([N+](=O)[O-])cc1 ZINC000423278259 290004890 /nfs/dbraw/zinc/00/48/90/290004890.db2.gz QLMXTPVBZKMMTA-NJZAAPMLSA-N 2 0 277.368 2.763 20 5 CFBDRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1cccc([N+](=O)[O-])c1 ZINC000570162290 322516979 /nfs/dbraw/zinc/51/69/79/322516979.db2.gz JDAMWKCGZLZBPS-LBPRGKRZSA-N 2 0 285.347 2.904 20 5 CFBDRP Cc1c(C[N@H+](C)CC2CC[NH+](C)CC2)cccc1[N+](=O)[O-] ZINC000104086546 618972910 /nfs/dbraw/zinc/97/29/10/618972910.db2.gz WTSFBLOQSKLLDD-UHFFFAOYSA-N 2 0 291.395 2.677 20 5 CFBDRP C[C@@H]([NH3+])C1CC[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000093633656 619041582 /nfs/dbraw/zinc/04/15/82/619041582.db2.gz VSJQMLDVIIESAI-SNVBAGLBSA-N 2 0 297.786 2.807 20 5 CFBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)CC(C)(C)C[NH3+] ZINC000093861253 619062798 /nfs/dbraw/zinc/06/27/98/619062798.db2.gz FHUHEXOWOAAUFO-LLVKDONJSA-N 2 0 265.357 2.573 20 5 CFBDRP C[C@@H]([NH2+][C@H]1C[C@@H]([NH3+])C12CCC2)c1ccc([N+](=O)[O-])cc1 ZINC000925826415 619153735 /nfs/dbraw/zinc/15/37/35/619153735.db2.gz MKNFFIOTRSWFKC-HONMWMINSA-N 2 0 275.352 2.515 20 5 CFBDRP C[C@H](C[NH2+][C@@H]1CCCC[C@@H]1C[NH3+])c1ccccc1[N+](=O)[O-] ZINC000902432115 621077596 /nfs/dbraw/zinc/07/75/96/621077596.db2.gz VDSJXHZAXDSBOS-UMVBOHGHSA-N 2 0 291.395 2.805 20 5 CFBDRP C[C@H](C[NH2+][C@H]1C[C@@H]([NH3+])C12CCC2)c1ccccc1[N+](=O)[O-] ZINC000902431619 621077632 /nfs/dbraw/zinc/07/76/32/621077632.db2.gz SZXXWKIYJKSQHP-DFBGVHRSSA-N 2 0 289.379 2.558 20 5 CFBDRP C[C@H]([NH2+]C[C@@H]1CC[NH2+][C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000903987443 621499531 /nfs/dbraw/zinc/49/95/31/621499531.db2.gz GJCJZAANJZVCRM-FRRDWIJNSA-N 2 0 277.368 2.634 20 5 CFBDRP C[C@@H]([NH2+]CC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc([N+](=O)[O-])cc1 ZINC000903988822 621500326 /nfs/dbraw/zinc/50/03/26/621500326.db2.gz XXTZSYDVWPSYNT-IKKMQULASA-N 2 0 289.379 2.776 20 5 CFBDRP CC(C)c1ccc(C[N@@H+]2CC[C@H](CC[NH3+])C2)cc1[N+](=O)[O-] ZINC000904411302 621592509 /nfs/dbraw/zinc/59/25/09/621592509.db2.gz UIBPIGZMDMGENK-ZDUSSCGKSA-N 2 0 291.395 2.889 20 5 CFBDRP [NH3+]CC[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000070171165 625278871 /nfs/dbraw/zinc/27/88/71/625278871.db2.gz PKGODBUSCRUNMU-NSHDSACASA-N 2 0 297.786 2.809 20 5 CFBDRP [NH3+]CCCCCC[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000843129697 631849122 /nfs/dbraw/zinc/84/91/22/631849122.db2.gz XSHYMWVHYIFOJF-VQHVLOKHSA-N 2 0 277.368 2.717 20 5 CFBDRP CC(C)[C@H]([NH3+])CCNCc1cc([N+](=O)[O-])ccc1Cl ZINC000853247405 634950034 /nfs/dbraw/zinc/95/00/34/634950034.db2.gz OKPJYCGXHKEKRI-CYBMUJFWSA-N 2 0 285.775 2.711 20 5 CFBDRP C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CCCC[NH+](C)C ZINC000866250299 638779971 /nfs/dbraw/zinc/77/99/71/638779971.db2.gz YDMZRZIKTGQPFJ-GFCCVEGCSA-N 2 0 297.374 2.596 20 5 CFBDRP C[C@@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])C1CC[NH2+]CC1 ZINC000873219872 642072859 /nfs/dbraw/zinc/07/28/59/642072859.db2.gz APPPMFCTHNILJW-SNVBAGLBSA-N 2 0 297.786 2.726 20 5 CFBDRP C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)C1CC[NH2+]CC1 ZINC000873221712 642075346 /nfs/dbraw/zinc/07/53/46/642075346.db2.gz OEODVKBEUFWBGP-SNVBAGLBSA-N 2 0 297.786 2.726 20 5 CFBDRP C[C@@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccccc1[N+](=O)[O-] ZINC000873297597 642128724 /nfs/dbraw/zinc/12/87/24/642128724.db2.gz YITYBBZAQICSAM-AAVRWANBSA-N 2 0 289.379 2.634 20 5 CFBDRP O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000250019208 650970424 /nfs/dbraw/zinc/97/04/24/650970424.db2.gz ZWGLEMANQZBUNB-ARFHVFGLSA-N 2 0 289.379 2.605 20 5 CFBDRP CC1(C)C[C@@H]([NH3+])C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000925597335 648232351 /nfs/dbraw/zinc/23/23/51/648232351.db2.gz YIIUOWMSXSLRNZ-QWHCGFSZSA-N 2 0 277.368 2.590 20 5 CFBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H]2CC[NH+](C)C[C@@H]2C1 ZINC000931438077 649427621 /nfs/dbraw/zinc/42/76/21/649427621.db2.gz ZGCYQHBMHGCFGE-MELADBBJSA-N 2 0 289.379 2.539 20 5 CFBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H]2CC[NH+](C)C[C@@H]2C1 ZINC000931438076 649427812 /nfs/dbraw/zinc/42/78/12/649427812.db2.gz ZGCYQHBMHGCFGE-HZSPNIEDSA-N 2 0 289.379 2.539 20 5 CFBDRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000594520202 349440796 /nfs/dbraw/zinc/44/07/96/349440796.db2.gz IWGYQCUCKMOCBT-CJORGLJHSA-N 2 0 289.379 2.538 20 5 CFBDRP CC(C)[C@H]([NH3+])CC[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000596101325 349794765 /nfs/dbraw/zinc/79/47/65/349794765.db2.gz FVELCTHEIHBPDM-BRLPQQTGSA-N 2 0 277.368 2.571 20 5 CFBDRP C[C@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]1CC[NH3+] ZINC000404314092 348590650 /nfs/dbraw/zinc/59/06/50/348590650.db2.gz AFADDNVFJLPFQQ-GXTWGEPZSA-N 2 0 277.368 2.544 20 5 CFBDRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccccc1[N+](=O)[O-] ZINC000592471106 349126420 /nfs/dbraw/zinc/12/64/20/349126420.db2.gz YITYBBZAQICSAM-IGQOVBAYSA-N 2 0 289.379 2.634 20 5 CFBDRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccccc1[N+](=O)[O-] ZINC000592471109 349126762 /nfs/dbraw/zinc/12/67/62/349126762.db2.gz YITYBBZAQICSAM-XDQVBPFNSA-N 2 0 289.379 2.634 20 5 CFBDRP C[NH2+]Cc1ccccc1C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000593318325 349246558 /nfs/dbraw/zinc/24/65/58/349246558.db2.gz NYUFNSWIFXWCDE-UHFFFAOYSA-N 2 0 299.374 2.912 20 5 CFBDRP CC[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000271818876 191346759 /nfs/dbraw/zinc/34/67/59/191346759.db2.gz BWVIYMZICNSBJB-INIZCTEOSA-N 2 0 289.379 2.897 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)cc1[N+](=O)[O-] ZINC000420397393 236638134 /nfs/dbraw/zinc/63/81/34/236638134.db2.gz GBPOQJSBLPCNFG-STQMWFEESA-N 2 0 277.368 2.553 20 5 CFBDRP [NH3+][C@@H]1C[C@@H]([NH2+]CCc2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000422778565 237194859 /nfs/dbraw/zinc/19/48/59/237194859.db2.gz ASMWFIKXXCVFNM-HZPDHXFCSA-N 2 0 297.358 2.872 20 5 CFBDRP C[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1 ZINC000423265219 238320802 /nfs/dbraw/zinc/32/08/02/238320802.db2.gz ZRNXQRKASABJGF-STQMWFEESA-N 2 0 277.368 2.635 20 5 CFBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000423274077 238330317 /nfs/dbraw/zinc/33/03/17/238330317.db2.gz JSZNMESEKZCLBB-BPLDGKMQSA-N 2 0 291.395 2.633 20 5 CFBDRP CC[N@H+](Cc1ccc([N+](=O)[O-])cc1C)[C@@H]1CCC[NH2+]CC1 ZINC000435394667 240312366 /nfs/dbraw/zinc/31/23/66/240312366.db2.gz ONFCHPQFHMKNDP-OAHLLOKOSA-N 2 0 291.395 2.867 20 5 CFBDRP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000037649074 372684831 /nfs/dbraw/zinc/68/48/31/372684831.db2.gz RLMAZQJYXUPRKH-OLZOCXBDSA-N 2 0 289.379 2.730 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+]CCCC[NH+](C)C)cc1[N+](=O)[O-] ZINC000045663757 373027788 /nfs/dbraw/zinc/02/77/88/373027788.db2.gz QWIMRZFZDLBOST-CYBMUJFWSA-N 2 0 279.384 2.896 20 5 CFBDRP O=[N+]([O-])c1ccccc1C[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000063197932 373794296 /nfs/dbraw/zinc/79/42/96/373794296.db2.gz CQRMMPXAEUINOB-OAHLLOKOSA-N 2 0 289.379 2.559 20 5 CFBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](CC[NH3+])C1 ZINC000070169611 374135068 /nfs/dbraw/zinc/13/50/68/374135068.db2.gz OJFWLZPPMOBLJS-CHWSQXEVSA-N 2 0 277.368 2.717 20 5 CFBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC000414954933 381646752 /nfs/dbraw/zinc/64/67/52/381646752.db2.gz SYIGFRJMAAOXCK-GUTXKFCHSA-N 2 0 291.395 2.646 20 5 CFBDRP O=[N+]([O-])c1ccccc1/C=C\C[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000414967120 381664368 /nfs/dbraw/zinc/66/43/68/381664368.db2.gz GVUSMNKBVFLGAO-YFUKIHRRSA-N 2 0 289.379 2.730 20 5 CFBDRP C[C@H]([NH3+])[C@H](C)[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000423433430 383094842 /nfs/dbraw/zinc/09/48/42/383094842.db2.gz CJIATJDVNQFWAC-ABHRYQDASA-N 2 0 291.395 2.631 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCC[NH+](C)C ZINC000532218621 383994305 /nfs/dbraw/zinc/99/43/05/383994305.db2.gz BSGKOWMEWPTYAM-ZDUSSCGKSA-N 2 0 279.384 2.896 20 5 CFBDRP C[C@@H]([NH2+]C1CCC(C[NH3+])CC1)c1cccc([N+](=O)[O-])c1 ZINC000422950058 533336901 /nfs/dbraw/zinc/33/69/01/533336901.db2.gz VBTBPWYTKBLPBK-LKSINWNRSA-N 2 0 277.368 2.763 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424367399 393840436 /nfs/dbraw/zinc/84/04/36/393840436.db2.gz LXCXTWRVVMYJHA-BPLDGKMQSA-N 2 0 291.395 2.775 20 5 CFBDRP CC[NH+]1CCC(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000044518587 175190796 /nfs/dbraw/zinc/19/07/96/175190796.db2.gz QGMTUTOSRAOGDX-UHFFFAOYSA-N 2 0 291.395 2.725 20 5 CFBDRP CC(C)c1ccc(C[NH2+][C@@H]2CC[C@H](C[NH3+])C2)cc1[N+](=O)[O-] ZINC000415047300 276053589 /nfs/dbraw/zinc/05/35/89/276053589.db2.gz VQOKELMVWBHSFT-GXTWGEPZSA-N 2 0 291.395 2.935 20 5 CFBDRP CC[NH+](CC)CCC[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449223717 276325695 /nfs/dbraw/zinc/32/56/95/276325695.db2.gz YQBAMDNWNIHGRW-AWEZNQCLSA-N 2 0 293.411 2.847 20 5 CFBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000423278194 278298596 /nfs/dbraw/zinc/29/85/96/278298596.db2.gz QTEUHHUURXDISM-KBPBESRZSA-N 2 0 291.395 2.505 20 5 CFBDRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccc([N+](=O)[O-])cc1 ZINC000423346223 278339931 /nfs/dbraw/zinc/33/99/31/278339931.db2.gz ZNPGVPBDMXKIGZ-GFCCVEGCSA-N 2 0 277.368 2.635 20 5 CFBDRP C[C@@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1ccc([N+](=O)[O-])cc1 ZINC000423260833 278348272 /nfs/dbraw/zinc/34/82/72/278348272.db2.gz QVZLNLXRCLBOGG-OLZOCXBDSA-N 2 0 277.368 2.635 20 5 CFBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC[C@H]([NH3+])C1 ZINC000423471497 279382093 /nfs/dbraw/zinc/38/20/93/279382093.db2.gz MHULIVHHCNEOKZ-NFAWXSAZSA-N 2 0 291.395 2.633 20 5 CFBDRP C[C@H](C[NH3+])C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000423308909 298530065 /nfs/dbraw/zinc/53/00/65/298530065.db2.gz PFIMICFQZWZIFM-YGRLFVJLSA-N 2 0 277.368 2.502 20 5 CFBDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000163262073 322374522 /nfs/dbraw/zinc/37/45/22/322374522.db2.gz WIFGKLLJUUZTRC-KBPBESRZSA-N 2 0 291.395 2.896 20 5 CFBDRP CC[NH2+]CCCN[C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000582719803 325228289 /nfs/dbraw/zinc/22/82/89/325228289.db2.gz QFSCEZMDRDXSHP-OAHLLOKOSA-N 2 0 277.368 2.561 20 5 CFBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC[C@H](C)[NH+](C)C ZINC000895292520 618514973 /nfs/dbraw/zinc/51/49/73/618514973.db2.gz CXNBLTOJWWELGH-ZVHGMHCTSA-N 2 0 291.395 2.928 20 5 CFBDRP C[C@H](C[NH2+][C@H]1CC[NH2+]CC[C@@H]1C)c1ccccc1[N+](=O)[O-] ZINC000902432065 621077590 /nfs/dbraw/zinc/07/75/90/621077590.db2.gz UUKQFUFDQOHFIY-GUTXKFCHSA-N 2 0 291.395 2.676 20 5 CFBDRP CC1(C)C[C@H]([NH2+][C@H]2C[C@H](C[NH3+])C2)c2cc([N+](=O)[O-])ccc21 ZINC000902483728 621110333 /nfs/dbraw/zinc/11/03/33/621110333.db2.gz AJCCSDVTRFDDFD-PGUXBMHVSA-N 2 0 289.379 2.644 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CC[C@H]([NH3+])C2)cc1[N+](=O)[O-] ZINC000903458972 621380717 /nfs/dbraw/zinc/38/07/17/621380717.db2.gz OPMKDZZPKWORBZ-SCRDCRAPSA-N 2 0 277.368 2.681 20 5 CFBDRP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000841057101 631323901 /nfs/dbraw/zinc/32/39/01/631323901.db2.gz HYMMIUABERACRS-QWRGUYRKSA-N 2 0 283.759 2.608 20 5 CFBDRP O=[N+]([O-])c1ccc(C[NH2+]CCC[C@H]2CCC[NH2+]2)cc1Cl ZINC000841073448 631330452 /nfs/dbraw/zinc/33/04/52/631330452.db2.gz UHZAPLYXSFNYHC-LBPRGKRZSA-N 2 0 297.786 2.870 20 5 CFBDRP C[N@H+](CC[C@@H]1CC[NH2+]C1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000842471751 631639177 /nfs/dbraw/zinc/63/91/77/631639177.db2.gz XDWHILKCTKPDFL-NSHDSACASA-N 2 0 297.786 2.680 20 5 CFBDRP C[C@H]([NH2+]CCCCCC[NH3+])c1ccc([N+](=O)[O-])cc1 ZINC000843342645 631932621 /nfs/dbraw/zinc/93/26/21/631932621.db2.gz NZBPENDTODYPFE-LBPRGKRZSA-N 2 0 265.357 2.765 20 5 CFBDRP C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C1CC[NH2+]CC1 ZINC000873220124 642072633 /nfs/dbraw/zinc/07/26/33/642072633.db2.gz JWAMYDULSGMPJX-JTQLQIEISA-N 2 0 297.786 2.726 20 5 CFBDRP C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C1CC[NH2+]CC1 ZINC000873220125 642072972 /nfs/dbraw/zinc/07/29/72/642072972.db2.gz JWAMYDULSGMPJX-SNVBAGLBSA-N 2 0 297.786 2.726 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+][C@@H](C)C2CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000873270068 642111790 /nfs/dbraw/zinc/11/17/90/642111790.db2.gz OQTLHHNVXDSPAK-QWHCGFSZSA-N 2 0 291.395 2.942 20 5 CFBDRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1OCC[N+](C)(C)C ZINC001224776497 775271122 /nfs/dbraw/zinc/27/11/22/775271122.db2.gz WKZJBSWJGAMICF-SJLPKXTDSA-N 2 0 291.459 2.620 20 5 CFBDRP Cc1c(C[N@H+](C)CCCCCC[NH3+])cccc1[N+](=O)[O-] ZINC000710843787 781341851 /nfs/dbraw/zinc/34/18/51/781341851.db2.gz ZBIQALWTZBZMAE-UHFFFAOYSA-N 2 0 279.384 2.854 20 5 CFBDRP CC[N+](C)(C)Cc1ccccc1N[C@@H](C)C[NH+](C)C ZINC001163776604 781573265 /nfs/dbraw/zinc/57/32/65/781573265.db2.gz FJJQCJBNSSTLLT-AWEZNQCLSA-N 2 0 264.437 2.645 20 5 CFBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(CC[NH3+])CC1 ZINC000070183574 346907045 /nfs/dbraw/zinc/90/70/45/346907045.db2.gz CDVUBFUDKOVQBR-LBPRGKRZSA-N 2 0 277.368 2.717 20 5 CFBDRP C[C@@H]([NH2+][C@H](C)C1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000037775681 346333595 /nfs/dbraw/zinc/33/35/95/346333595.db2.gz KIBUPWYWLHLJPI-CHWSQXEVSA-N 2 0 291.395 2.976 20 5 CFBDRP CC[NH2+]CCC[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000591577176 349030647 /nfs/dbraw/zinc/03/06/47/349030647.db2.gz WFHWCRWBOVWNMA-OAHLLOKOSA-N 2 0 291.395 2.505 20 5 CFBDRP CC[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1cccc([N+](=O)[O-])c1 ZINC000591579269 349031623 /nfs/dbraw/zinc/03/16/23/349031623.db2.gz FMFNJARWDHPLTK-CABCVRRESA-N 2 0 289.379 2.778 20 5 CFBDRP Cc1c([C@H](C)[NH2+]CCC2CC[NH2+]CC2)cccc1[N+](=O)[O-] ZINC000593321357 349247184 /nfs/dbraw/zinc/24/71/84/349247184.db2.gz IPRQGKWSERTVNG-ZDUSSCGKSA-N 2 0 291.395 2.944 20 5 CFBDRP C[C@H]([NH3+])CC[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000414826177 233368155 /nfs/dbraw/zinc/36/81/55/233368155.db2.gz VCFMZTKNRVGAJP-YDHLFZDLSA-N 2 0 291.395 2.633 20 5 CFBDRP C[C@@H]1C[C@@H](C)N(Cc2c(F)cccc2[N+](=O)[O-])C[C@H]1C[NH3+] ZINC000422638172 237118777 /nfs/dbraw/zinc/11/87/77/237118777.db2.gz PWEXRBGBAVRGCR-IJLUTSLNSA-N 2 0 295.358 2.539 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@H](C)C[C@H](C)[NH3+])cc1[N+](=O)[O-] ZINC000422918357 237346714 /nfs/dbraw/zinc/34/67/14/237346714.db2.gz HDMGAEPAOULAQY-TUAOUCFPSA-N 2 0 265.357 2.680 20 5 CFBDRP C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1ccccc1[N+](=O)[O-] ZINC000423016567 296145651 /nfs/dbraw/zinc/14/56/51/296145651.db2.gz MYALXPQGSSRLGQ-NWDGAFQWSA-N 2 0 265.357 2.763 20 5 CFBDRP Cc1ccc(C[NH2+]CC[C@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000459733064 245289651 /nfs/dbraw/zinc/28/96/51/245289651.db2.gz NBUTZTPCSPBULY-CQSZACIVSA-N 2 0 291.395 2.725 20 5 CFBDRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)c1cccc([N+](=O)[O-])c1 ZINC000037644165 372681146 /nfs/dbraw/zinc/68/11/46/372681146.db2.gz BXRCZWCDZJGMDY-BBRMVZONSA-N 2 0 291.395 2.977 20 5 CFBDRP CN(CC[C@H]1CCCC[N@@H+]1C)Cc1ccccc1[N+](=O)[O-] ZINC000173961229 379806633 /nfs/dbraw/zinc/80/66/33/379806633.db2.gz WSYYGZRZQNFSCY-OAHLLOKOSA-N 2 0 291.395 2.901 20 5 CFBDRP CC[N@@H+]1CC[C@@H](N(C)Cc2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000174776310 379937967 /nfs/dbraw/zinc/93/79/67/379937967.db2.gz LAGADGYPMJXLDN-CZUORRHYSA-N 2 0 291.395 2.757 20 5 CFBDRP C[C@H]([NH3+])C1CC[NH+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000347183469 380990299 /nfs/dbraw/zinc/99/02/99/380990299.db2.gz XHBXSHCNBBNIBW-BPJJOFIESA-N 2 0 289.379 2.667 20 5 CFBDRP CCC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)C1CC[NH2+]CC1 ZINC000347208506 381004660 /nfs/dbraw/zinc/00/46/60/381004660.db2.gz NJYWQPFGVYJNRF-UHFFFAOYSA-N 2 0 291.395 2.867 20 5 CFBDRP C[C@@H](CCCC[NH3+])[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000415016897 381711056 /nfs/dbraw/zinc/71/10/56/381711056.db2.gz QOLVYFUSJIEHMA-PPGNKHEKSA-N 2 0 277.368 2.715 20 5 CFBDRP [NH3+]C[C@H]1CC[C@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000415025314 381718516 /nfs/dbraw/zinc/71/85/16/381718516.db2.gz PSEMTEVKWPTZFS-HAQNSBGRSA-N 2 0 295.358 2.589 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1 ZINC000420314333 382362951 /nfs/dbraw/zinc/36/29/51/382362951.db2.gz VOZSHEFNIRAPBG-APYUEPQZSA-N 2 0 289.379 2.633 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+]CCC2CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000420409223 382401419 /nfs/dbraw/zinc/40/14/19/382401419.db2.gz QIWSVCJQKIRFFR-ZDUSSCGKSA-N 2 0 291.395 2.944 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+]CC[C@@H]2CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000420413190 382403219 /nfs/dbraw/zinc/40/32/19/382403219.db2.gz SUKSLOVHDBACMD-KBPBESRZSA-N 2 0 291.395 2.944 20 5 CFBDRP C[NH2+]CCC1CC[NH+](Cc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000346653873 382457299 /nfs/dbraw/zinc/45/72/99/382457299.db2.gz QQYXDULBUAAMFO-UHFFFAOYSA-N 2 0 291.395 2.725 20 5 CFBDRP C[NH2+]C[C@@H]1CCCN([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000218060262 382788700 /nfs/dbraw/zinc/78/87/00/382788700.db2.gz CDGRZZRXQWLNKG-STQMWFEESA-N 2 0 277.368 2.587 20 5 CFBDRP [NH3+]C[C@H]1CCC[C@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000423037372 383023386 /nfs/dbraw/zinc/02/33/86/383023386.db2.gz BHDDTCKLOMAJKR-DGCLKSJQSA-N 2 0 297.786 2.508 20 5 CFBDRP CC(C)[C@H]([NH3+])CC[N@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000251338664 383387067 /nfs/dbraw/zinc/38/70/67/383387067.db2.gz PROVUIDREKXPSV-IUODEOHRSA-N 2 0 279.384 2.961 20 5 CFBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H]2CCC[C@@H]([NH3+])[C@H]2C1 ZINC000252840208 383437343 /nfs/dbraw/zinc/43/73/43/383437343.db2.gz BMEZGTGZQZLEAC-PAPYEOQZSA-N 2 0 289.379 2.715 20 5 CFBDRP C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(C[NH+](C)C)CC1 ZINC000488396301 383529167 /nfs/dbraw/zinc/52/91/67/383529167.db2.gz JJTOIQFJEODVJW-CYBMUJFWSA-N 2 0 291.395 2.929 20 5 CFBDRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000249376482 131120662 /nfs/dbraw/zinc/12/06/62/131120662.db2.gz KKBHGOHJJUPVDV-CHWSQXEVSA-N 2 0 277.368 2.587 20 5 CFBDRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1ccc([N+](=O)[O-])cc1 ZINC000423218622 394273470 /nfs/dbraw/zinc/27/34/70/394273470.db2.gz SCVZWSGULLVIBF-SGMGOOAPSA-N 2 0 277.368 2.634 20 5 CFBDRP Cc1c([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)C2)cccc1[N+](=O)[O-] ZINC000158175889 394355110 /nfs/dbraw/zinc/35/51/10/394355110.db2.gz GCAJITAUAGNHOW-KBPBESRZSA-N 2 0 291.395 2.896 20 5 CFBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000414826864 533682834 /nfs/dbraw/zinc/68/28/34/533682834.db2.gz GISKACJVPDGZHT-UONOGXRCSA-N 2 0 291.395 2.505 20 5 CFBDRP C[C@H]([NH3+])[C@H](C)[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000423433431 278230392 /nfs/dbraw/zinc/23/03/92/278230392.db2.gz CJIATJDVNQFWAC-PWNZVWSESA-N 2 0 291.395 2.631 20 5 CFBDRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1ccc([N+](=O)[O-])cc1 ZINC000423372124 278282012 /nfs/dbraw/zinc/28/20/12/278282012.db2.gz GUICYSDYIZOIET-DRZSPHRISA-N 2 0 263.341 2.515 20 5 CFBDRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000125435581 278343159 /nfs/dbraw/zinc/34/31/59/278343159.db2.gz APHSYRKBZPTXRN-CYBMUJFWSA-N 2 0 291.395 2.977 20 5 CFBDRP C[C@H]([NH2+]C1CCC(C[NH3+])CC1)c1ccccc1[N+](=O)[O-] ZINC000423019159 533803104 /nfs/dbraw/zinc/80/31/04/533803104.db2.gz UFUQDAYCJOBJFK-HIFPTAJRSA-N 2 0 277.368 2.763 20 5 CFBDRP [NH3+]CC[C@H]1CCC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000442920085 534653307 /nfs/dbraw/zinc/65/33/07/534653307.db2.gz GJPDKECVIVANKO-HJHHMULASA-N 2 0 289.379 2.669 20 5 CFBDRP CCC[C@H]([NH2+]C[C@@H](C)C[NH2+]C)c1cccc([N+](=O)[O-])c1 ZINC000423255487 528222821 /nfs/dbraw/zinc/22/28/21/528222821.db2.gz AFUBCZGRNWKQKR-WFASDCNBSA-N 2 0 279.384 2.881 20 5 CFBDRP CC[C@H]([NH2+]C1CCC([NH3+])CC1)c1cccc([N+](=O)[O-])c1 ZINC000051693016 618048655 /nfs/dbraw/zinc/04/86/55/618048655.db2.gz IXGDNFTXCKYAJY-PIMMBPRGSA-N 2 0 277.368 2.905 20 5 CFBDRP C[NH+](C)CC(C)(C)C[N@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000898308077 620370252 /nfs/dbraw/zinc/37/02/52/620370252.db2.gz NDGRSXUMPBTCEP-UHFFFAOYSA-N 2 0 293.411 2.657 20 5 CFBDRP CC1(C)C[NH2+]CC[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000902315785 621030885 /nfs/dbraw/zinc/03/08/85/621030885.db2.gz DJJACPOTNLEZFK-AWEZNQCLSA-N 2 0 291.395 2.505 20 5 CFBDRP Cc1c(C[NH2+][C@@H]2CC[NH2+]CC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000902375004 621046422 /nfs/dbraw/zinc/04/64/22/621046422.db2.gz FRNDOMLCWNQVAA-CQSZACIVSA-N 2 0 291.395 2.771 20 5 CFBDRP C[C@H](C[NH2+][C@H]1CCCCC[C@@H]1[NH3+])c1ccccc1[N+](=O)[O-] ZINC000902430069 621076711 /nfs/dbraw/zinc/07/67/11/621076711.db2.gz OAXLHTRSNKDHGR-SNPRPXQTSA-N 2 0 291.395 2.948 20 5 CFBDRP COc1cc([C@H](C)[NH2+]CCCC[NH+](C)C)cc([N+](=O)[O-])c1 ZINC000903083854 621246230 /nfs/dbraw/zinc/24/62/30/621246230.db2.gz OWSSEVHLEAOZKO-LBPRGKRZSA-N 2 0 295.383 2.596 20 5 CFBDRP CC[C@@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000903459488 621380437 /nfs/dbraw/zinc/38/04/37/621380437.db2.gz UIOCAEGFRDIHRA-OSAQELSMSA-N 2 0 277.368 2.763 20 5 CFBDRP C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](C[NH3+])[C@H](C)C1 ZINC000923498729 626477265 /nfs/dbraw/zinc/47/72/65/626477265.db2.gz JJJLHNZVKZBMHE-MBNYWOFBSA-N 2 0 277.368 2.573 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1C[C@@H]2CC[NH2+]C[C@@H]2C1 ZINC000923522687 626478688 /nfs/dbraw/zinc/47/86/88/626478688.db2.gz YQVYWRALKAVFIR-HZSPNIEDSA-N 2 0 289.379 2.506 20 5 CFBDRP C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])C1CCC([NH3+])CC1 ZINC000843055891 631819104 /nfs/dbraw/zinc/81/91/04/631819104.db2.gz RGVHROYBHUZDLS-XQRVVYSFSA-N 2 0 289.379 2.810 20 5 CFBDRP COc1ccc(C[N@H+](C)CCCCCC[NH3+])cc1[N+](=O)[O-] ZINC000846218656 632664957 /nfs/dbraw/zinc/66/49/57/632664957.db2.gz VCWWPUFRIAUUKU-UHFFFAOYSA-N 2 0 295.383 2.554 20 5 CFBDRP CC(C)(C)[C@@]1(C[NH3+])CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000866704697 638868379 /nfs/dbraw/zinc/86/83/79/638868379.db2.gz WTZDPGJPBOYKQN-MRXNPFEDSA-N 2 0 291.395 2.792 20 5 CFBDRP Cc1c(C[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)cccc1[N+](=O)[O-] ZINC000873130250 642022420 /nfs/dbraw/zinc/02/24/20/642022420.db2.gz CFQZDWGINIWTQE-AWEZNQCLSA-N 2 0 291.395 2.725 20 5 CFBDRP CCC[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000873258349 642103700 /nfs/dbraw/zinc/10/37/00/642103700.db2.gz OQOSROZKEZAPQJ-WHOFXGATSA-N 2 0 277.368 2.763 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@H]2C[C@@H]([NH3+])C23CCC3)cc1[N+](=O)[O-] ZINC000925575917 648224472 /nfs/dbraw/zinc/22/44/72/648224472.db2.gz JANGULHTTMMWEG-GLQYFDAESA-N 2 0 289.379 2.824 20 5 CFBDRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000594510084 349435105 /nfs/dbraw/zinc/43/51/05/349435105.db2.gz OTUFHXFWIZCJBU-JMSVASOKSA-N 2 0 277.368 2.586 20 5 CFBDRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000594513029 349436725 /nfs/dbraw/zinc/43/67/25/349436725.db2.gz KHPNURJHEGTABB-GSJFWJNXSA-N 2 0 297.786 2.678 20 5 CFBDRP C[N@@H+]1CC[C@]2(C1)CCCN(Cc1cccc([N+](=O)[O-])c1)C2 ZINC000595507477 349645480 /nfs/dbraw/zinc/64/54/80/349645480.db2.gz OJTABAVGLIFQNF-INIZCTEOSA-N 2 0 289.379 2.513 20 5 CFBDRP C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C1CC[NH+](C)CC1 ZINC000037775680 346333278 /nfs/dbraw/zinc/33/32/78/346333278.db2.gz KIBUPWYWLHLJPI-OLZOCXBDSA-N 2 0 291.395 2.976 20 5 CFBDRP Cc1c([C@H](C)[NH2+][C@H]2CCC[NH2+]CC2)cccc1[N+](=O)[O-] ZINC000591578242 349032023 /nfs/dbraw/zinc/03/20/23/349032023.db2.gz DVUVURYFOYLHHC-STQMWFEESA-N 2 0 277.368 2.696 20 5 CFBDRP C[NH2+]Cc1ccccc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1C ZINC000593318038 349246744 /nfs/dbraw/zinc/24/67/44/349246744.db2.gz NNFPDQZJRPLUAT-UHFFFAOYSA-N 2 0 299.374 2.912 20 5 CFBDRP O=[N+]([O-])c1ccccc1/C=C/C[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000414849358 233376847 /nfs/dbraw/zinc/37/68/47/233376847.db2.gz LSMPJBRAWFTOPK-GBXSZLQWSA-N 2 0 289.379 2.587 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000414827333 233368190 /nfs/dbraw/zinc/36/81/90/233368190.db2.gz KJFPKPAAMDNOEN-ZIAGYGMSSA-N 2 0 291.395 2.505 20 5 CFBDRP C[N@@H+]1CC[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1(C)C ZINC000598962731 350349870 /nfs/dbraw/zinc/34/98/70/350349870.db2.gz IQSZMKXXAHOXNH-AWEZNQCLSA-N 2 0 291.395 2.600 20 5 CFBDRP C[N@@H+]1CCCC[C@H](CNCc2ccc([N+](=O)[O-])cc2F)C1 ZINC000598995256 350356530 /nfs/dbraw/zinc/35/65/30/350356530.db2.gz WXJCJQBAYOPOKP-GFCCVEGCSA-N 2 0 295.358 2.555 20 5 CFBDRP CC(C)(C)N1CC[C@@H]1C[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000602704951 350989037 /nfs/dbraw/zinc/98/90/37/350989037.db2.gz IODMHEIEWPQOCT-OAHLLOKOSA-N 2 0 291.395 2.600 20 5 CFBDRP C[NH+]1CCC2(CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)CC1 ZINC000602876060 351054936 /nfs/dbraw/zinc/05/49/36/351054936.db2.gz CPMPIVRQNJDIGM-UHFFFAOYSA-N 2 0 289.379 2.513 20 5 CFBDRP CC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@H]1CCC[NH2+]CC1 ZINC000435379355 240307820 /nfs/dbraw/zinc/30/78/20/240307820.db2.gz BOAJANDLMOVTPC-HNNXBMFYSA-N 2 0 291.395 2.867 20 5 CFBDRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000037644207 372682544 /nfs/dbraw/zinc/68/25/44/372682544.db2.gz KKBHGOHJJUPVDV-QWHCGFSZSA-N 2 0 277.368 2.587 20 5 CFBDRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1cccc([N+](=O)[O-])c1 ZINC000045663738 373027236 /nfs/dbraw/zinc/02/72/36/373027236.db2.gz ICNGILWYOCSDQI-GFCCVEGCSA-N 2 0 265.357 2.587 20 5 CFBDRP C[C@@H](CCC[NH3+])[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000415017463 381711510 /nfs/dbraw/zinc/71/15/10/381711510.db2.gz FODVMBKSGROBQF-STQMWFEESA-N 2 0 279.384 2.633 20 5 CFBDRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000415020863 381715304 /nfs/dbraw/zinc/71/53/04/381715304.db2.gz XXUUGAJPTOFWRH-SNVBAGLBSA-N 2 0 285.775 2.855 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H](C)[C@H](C[NH3+])C1 ZINC000420406844 382401500 /nfs/dbraw/zinc/40/15/00/382401500.db2.gz OCHNFXOINFPZES-FPMFFAJLSA-N 2 0 291.395 2.881 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+]CCC2CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000420409220 382401745 /nfs/dbraw/zinc/40/17/45/382401745.db2.gz QIWSVCJQKIRFFR-CYBMUJFWSA-N 2 0 291.395 2.944 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000420418634 382402809 /nfs/dbraw/zinc/40/28/09/382402809.db2.gz XBWQOSKNUFIEHT-STQMWFEESA-N 2 0 277.368 2.553 20 5 CFBDRP CC(C)[N@H+](C)CCCN[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000219149478 382792437 /nfs/dbraw/zinc/79/24/37/382792437.db2.gz DLWZIFRUMVIULS-CYBMUJFWSA-N 2 0 279.384 2.976 20 5 CFBDRP CC[NH2+]CCC[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000578756791 382951139 /nfs/dbraw/zinc/95/11/39/382951139.db2.gz PXLROJQJFRRDMA-CYBMUJFWSA-N 2 0 279.384 2.505 20 5 CFBDRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000422916230 532965084 /nfs/dbraw/zinc/96/50/84/532965084.db2.gz CXFRIXISEYZQOA-OLZOCXBDSA-N 2 0 279.384 2.633 20 5 CFBDRP C[C@@H](CCCC[NH3+])[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000423049853 383031125 /nfs/dbraw/zinc/03/11/25/383031125.db2.gz YCYUCPRCDYZTEF-NSHDSACASA-N 2 0 299.802 2.898 20 5 CFBDRP Cc1c([C@H](C)[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)cccc1[N+](=O)[O-] ZINC000423363784 383065089 /nfs/dbraw/zinc/06/50/89/383065089.db2.gz AKRHOXPSZPHHIJ-YNEHKIRRSA-N 2 0 277.368 2.824 20 5 CFBDRP Cc1c([C@H](C)[NH2+][C@H]2CC[NH2+]C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000423398894 383081581 /nfs/dbraw/zinc/08/15/81/383081581.db2.gz PEAJBEYLERJWTR-JKOKRWQUSA-N 2 0 277.368 2.552 20 5 CFBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)[C@H](C)[NH3+] ZINC000423446072 383098958 /nfs/dbraw/zinc/09/89/58/383098958.db2.gz NQLLKSJJIQHDSP-QJPTWQEYSA-N 2 0 297.424 2.791 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])C2)cc1[N+](=O)[O-] ZINC000423489761 383117690 /nfs/dbraw/zinc/11/76/90/383117690.db2.gz GPVLNMIQOYWNLE-OBJOEFQTSA-N 2 0 277.368 2.681 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H](C[NH3+])C2)cc1[N+](=O)[O-] ZINC000423489764 383117822 /nfs/dbraw/zinc/11/78/22/383117822.db2.gz GPVLNMIQOYWNLE-SGMGOOAPSA-N 2 0 277.368 2.681 20 5 CFBDRP CC(C)[N@H+](C)CCC[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449072695 383161655 /nfs/dbraw/zinc/16/16/55/383161655.db2.gz KVNREPHPBFOTOE-CQSZACIVSA-N 2 0 293.411 2.846 20 5 CFBDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000532474888 384033500 /nfs/dbraw/zinc/03/35/00/384033500.db2.gz WIFGKLLJUUZTRC-KGLIPLIRSA-N 2 0 291.395 2.896 20 5 CFBDRP O=[N+]([O-])c1cccc(C[N@H+](CC2CC[NH2+]CC2)C2CC2)c1 ZINC000094021478 285153471 /nfs/dbraw/zinc/15/34/71/285153471.db2.gz KJZUVUZLEKOXNV-UHFFFAOYSA-N 2 0 289.379 2.559 20 5 CFBDRP C[C@@H](CC[NH3+])[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000414886888 533579740 /nfs/dbraw/zinc/57/97/40/533579740.db2.gz QBHMHYQGAKGTQG-NSHDSACASA-N 2 0 289.335 2.682 20 5 CFBDRP CC(C)([NH3+])C[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000414808842 393805913 /nfs/dbraw/zinc/80/59/13/393805913.db2.gz UKBYYCGQQTWFRQ-OCCSQVGLSA-N 2 0 291.395 2.633 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000126281676 394024742 /nfs/dbraw/zinc/02/47/42/394024742.db2.gz OXJVXYUBXAKFHT-CYBMUJFWSA-N 2 0 291.395 2.896 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000540607347 394649781 /nfs/dbraw/zinc/64/97/81/394649781.db2.gz PXIWAGONVRAWJZ-CYBMUJFWSA-N 2 0 289.379 2.816 20 5 CFBDRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])[C@@H]2CCC[C@@H]21 ZINC000353408726 163359733 /nfs/dbraw/zinc/35/97/33/163359733.db2.gz VAPGOPZNGMXGHH-DZKIICNBSA-N 2 0 289.379 2.557 20 5 CFBDRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccccc1[N+](=O)[O-] ZINC000044515215 175189972 /nfs/dbraw/zinc/18/99/72/175189972.db2.gz CVRAZZLIKRDKOT-GFCCVEGCSA-N 2 0 277.368 2.587 20 5 CFBDRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000423471693 274475804 /nfs/dbraw/zinc/47/58/04/274475804.db2.gz ZRFDWXNZFQTPIV-ABAIWWIYSA-N 2 0 277.368 2.689 20 5 CFBDRP CC(C)c1ccc(C[NH+]2CCC(C[NH3+])CC2)cc1[N+](=O)[O-] ZINC000346664981 278035664 /nfs/dbraw/zinc/03/56/64/278035664.db2.gz PGRMPDZFNAHNAT-UHFFFAOYSA-N 2 0 291.395 2.889 20 5 CFBDRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000332344258 288324860 /nfs/dbraw/zinc/32/48/60/288324860.db2.gz XTTJKWJQYOMSKJ-HFBAOOFYSA-N 2 0 289.379 2.560 20 5 CFBDRP C[C@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[NH2+]1 ZINC000422920627 533844800 /nfs/dbraw/zinc/84/48/00/533844800.db2.gz MJEOXGKTCVNMEE-XJKSGUPXSA-N 2 0 291.395 2.648 20 5 CFBDRP CC(C)c1ccc(C[NH2+]C[C@H]2CCC[NH2+]C2)cc1[N+](=O)[O-] ZINC000414841935 528100188 /nfs/dbraw/zinc/10/01/88/528100188.db2.gz ZSLQVSOFFYDIOB-AWEZNQCLSA-N 2 0 291.395 2.807 20 5 CFBDRP [NH3+][C@@H]1CC[C@H](C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000925880893 619201898 /nfs/dbraw/zinc/20/18/98/619201898.db2.gz WMFCDOXYRJXCAS-NORZTCDRSA-N 2 0 289.379 2.689 20 5 CFBDRP C[C@H](C[NH2+]CC1CC[NH+](C)CC1)c1ccccc1[N+](=O)[O-] ZINC000897461026 620176669 /nfs/dbraw/zinc/17/66/69/620176669.db2.gz XIWRNWGWXWKBJM-CYBMUJFWSA-N 2 0 291.395 2.630 20 5 CFBDRP CC[NH+]1CCC([NH2+]C[C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000897466667 620177349 /nfs/dbraw/zinc/17/73/49/620177349.db2.gz ZBUXEAYUGSTYBP-ZDUSSCGKSA-N 2 0 291.395 2.772 20 5 CFBDRP O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000841073092 631330570 /nfs/dbraw/zinc/33/05/70/631330570.db2.gz PVBFZQLMBAOGSM-ZDUSSCGKSA-N 2 0 297.786 2.870 20 5 CFBDRP O=[N+]([O-])c1ccc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)cc1Cl ZINC000841073447 631331329 /nfs/dbraw/zinc/33/13/29/631331329.db2.gz UHZAPLYXSFNYHC-GFCCVEGCSA-N 2 0 297.786 2.870 20 5 CFBDRP C[C@@H]([NH2+]CCCCCC[NH3+])c1ccc([N+](=O)[O-])cc1 ZINC000843342644 631932422 /nfs/dbraw/zinc/93/24/22/631932422.db2.gz NZBPENDTODYPFE-GFCCVEGCSA-N 2 0 265.357 2.765 20 5 CFBDRP C[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cccc([N+](=O)[O-])c1 ZINC000817946911 632749332 /nfs/dbraw/zinc/74/93/32/632749332.db2.gz HSRMMYLQQZRNOZ-CYBMUJFWSA-N 2 0 299.374 2.947 20 5 CFBDRP CC[NH2+]CC1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000113656314 635645240 /nfs/dbraw/zinc/64/52/40/635645240.db2.gz LSKLVUNMTRSVHJ-UHFFFAOYSA-N 2 0 295.358 2.555 20 5 CFBDRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866249602 638779872 /nfs/dbraw/zinc/77/98/72/638779872.db2.gz LWSAMKWRPSLWPN-RYUDHWBXSA-N 2 0 297.374 2.595 20 5 CFBDRP CC(C)(C)[C@]1(C[NH3+])CC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000866705174 638868011 /nfs/dbraw/zinc/86/80/11/638868011.db2.gz VCMJSQOOQCKAEC-INIZCTEOSA-N 2 0 291.395 2.792 20 5 CFBDRP CC(C)(C)[C@]1(C[NH3+])CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000866704269 638868034 /nfs/dbraw/zinc/86/80/34/638868034.db2.gz SGXODXDUYJFRFU-INIZCTEOSA-N 2 0 291.395 2.792 20 5 CFBDRP C[C@@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1ccc([N+](=O)[O-])cc1 ZINC000873270521 642112904 /nfs/dbraw/zinc/11/29/04/642112904.db2.gz WFNOWAWZLVOKSA-NEPJUHHUSA-N 2 0 277.368 2.634 20 5 CFBDRP CC1(C)[NH2+]CC[C@@H]1[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000925571811 648222868 /nfs/dbraw/zinc/22/28/68/648222868.db2.gz JGMZIQKIOHDBBP-HNNXBMFYSA-N 2 0 291.395 2.648 20 5 CFBDRP CC1(C)C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C[C@@H]([NH3+])C1 ZINC000925597334 648233048 /nfs/dbraw/zinc/23/30/48/648233048.db2.gz YIIUOWMSXSLRNZ-OLZOCXBDSA-N 2 0 277.368 2.590 20 5 CFBDRP C[C@@H]([NH2+]CCCc1cncn1C)c1ccc([N+](=O)[O-])cc1 ZINC000932177607 649559834 /nfs/dbraw/zinc/55/98/34/649559834.db2.gz CVJCKRNYBFDFRQ-GFCCVEGCSA-N 2 0 288.351 2.612 20 5 CFBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](C)C[NH3+] ZINC000423311193 529534464 /nfs/dbraw/zinc/53/44/64/529534464.db2.gz SVTQZWLBAOHAAE-RYUDHWBXSA-N 2 0 297.424 2.650 20 5 CFBDRP CC[C@H]([NH2+][C@H]1CCC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000422842961 529670413 /nfs/dbraw/zinc/67/04/13/529670413.db2.gz ZWOZNQVDXAQHNC-ZFWWWQNUSA-N 2 0 277.368 2.778 20 5 CFBDRP C[C@H](C[NH2+]C1CCC(C[NH3+])CC1)c1ccccc1[N+](=O)[O-] ZINC001120255481 781930964 /nfs/dbraw/zinc/93/09/64/781930964.db2.gz IVLULQHWDBHEEA-IYXRBSQSSA-N 2 0 291.395 2.805 20 5 CFBDRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000037644299 372680286 /nfs/dbraw/zinc/68/02/86/372680286.db2.gz UAIZWNOYVZCUQP-QWHCGFSZSA-N 2 0 277.368 2.587 20 5 CFBDRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000037644219 372682402 /nfs/dbraw/zinc/68/24/02/372682402.db2.gz ADUDLOGLTKLQOT-UONOGXRCSA-N 2 0 291.395 2.896 20 5 CFBDRP CCC[C@@H]([NH2+]CCCC[NH3+])c1cccc([N+](=O)[O-])c1 ZINC000037715228 372693024 /nfs/dbraw/zinc/69/30/24/372693024.db2.gz XNOYLJDXDAWASC-CQSZACIVSA-N 2 0 265.357 2.765 20 5 CFBDRP C[NH2+]CC1CC[NH+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000347059425 380913509 /nfs/dbraw/zinc/91/35/09/380913509.db2.gz WYRAACJSSZLSIT-GQCTYLIASA-N 2 0 289.379 2.539 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000414960945 381656118 /nfs/dbraw/zinc/65/61/18/381656118.db2.gz AWGPNBFANWETPB-CQSZACIVSA-N 2 0 277.368 2.525 20 5 CFBDRP C[C@H](CCC[NH3+])[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000415017460 381711568 /nfs/dbraw/zinc/71/15/68/381711568.db2.gz FODVMBKSGROBQF-CHWSQXEVSA-N 2 0 279.384 2.633 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)cc1[N+](=O)[O-] ZINC000420397392 382398085 /nfs/dbraw/zinc/39/80/85/382398085.db2.gz GBPOQJSBLPCNFG-QWHCGFSZSA-N 2 0 277.368 2.553 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1CN(C)CC[C@@H]([NH3+])C(C)C ZINC000346673524 382464993 /nfs/dbraw/zinc/46/49/93/382464993.db2.gz IAMLOLVUOBEXLR-OAHLLOKOSA-N 2 0 279.384 2.708 20 5 CFBDRP CC(C)[C@@H]([NH3+])CC[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000346693380 382478492 /nfs/dbraw/zinc/47/84/92/382478492.db2.gz MRZAASLRAXXNNB-VFADXPBXSA-N 2 0 291.395 2.913 20 5 CFBDRP CN1CCC([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192617672 382710677 /nfs/dbraw/zinc/71/06/77/382710677.db2.gz STUCUZNYXDQGHR-INIZCTEOSA-N 2 0 289.379 2.656 20 5 CFBDRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000422915028 382988495 /nfs/dbraw/zinc/98/84/95/382988495.db2.gz AKXMFHOWFWTCFG-ZBFHGGJFSA-N 2 0 291.395 2.635 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@H]([NH3+])C2)cc1[N+](=O)[O-] ZINC000423393630 383079379 /nfs/dbraw/zinc/07/93/79/383079379.db2.gz QSZOVAOVPZXWLA-UBHSHLNASA-N 2 0 277.368 2.824 20 5 CFBDRP C[C@H]([NH2+]C[C@H]1CCC[C@H]([NH3+])C1)c1ccc([N+](=O)[O-])cc1 ZINC000423458396 383103007 /nfs/dbraw/zinc/10/30/07/383103007.db2.gz JTCDZATWRODERH-OBJOEFQTSA-N 2 0 277.368 2.763 20 5 CFBDRP CC[C@@H]([NH3+])C[NH2+][C@@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000423458773 383103022 /nfs/dbraw/zinc/10/30/22/383103022.db2.gz HGPPUPOZHVDLBC-NEPJUHHUSA-N 2 0 297.424 2.792 20 5 CFBDRP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cccc([N+](=O)[O-])c1 ZINC000423479632 383113134 /nfs/dbraw/zinc/11/31/34/383113134.db2.gz MIFAAYYDDCEWAM-GXTWGEPZSA-N 2 0 277.368 2.778 20 5 CFBDRP Cc1c([C@H](C)[NH2+]CCCC[NH+](C)C)cccc1[N+](=O)[O-] ZINC000268981129 132094977 /nfs/dbraw/zinc/09/49/77/132094977.db2.gz HRNVDPKDWGZOPH-ZDUSSCGKSA-N 2 0 279.384 2.896 20 5 CFBDRP C[C@H]1CC2(C[N@@H+]1Cc1csc([N+](=O)[O-])c1)CC[NH2+]CC2 ZINC000424296706 393816162 /nfs/dbraw/zinc/81/61/62/393816162.db2.gz SFROVOQCHDHZEM-NSHDSACASA-N 2 0 295.408 2.620 20 5 CFBDRP C[NH+](C)C1CCC([NH2+]Cc2csc([N+](=O)[O-])c2)CC1 ZINC000421376674 394208122 /nfs/dbraw/zinc/20/81/22/394208122.db2.gz RZAKZBSURWQHQR-UHFFFAOYSA-N 2 0 283.397 2.619 20 5 CFBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCC[NH+]1CCCC1 ZINC000449224146 394257546 /nfs/dbraw/zinc/25/75/46/394257546.db2.gz ZYQVYAFHJQYOBA-CQSZACIVSA-N 2 0 291.395 2.601 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000540607356 394649927 /nfs/dbraw/zinc/64/99/27/394649927.db2.gz PXIWAGONVRAWJZ-ZDUSSCGKSA-N 2 0 289.379 2.816 20 5 CFBDRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000423016566 298391749 /nfs/dbraw/zinc/39/17/49/298391749.db2.gz MYALXPQGSSRLGQ-NEPJUHHUSA-N 2 0 265.357 2.763 20 5 CFBDRP C[NH+](C)C1CCC([NH2+]Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000353505465 163379957 /nfs/dbraw/zinc/37/99/57/163379957.db2.gz VOEREQQCLCFAAH-UHFFFAOYSA-N 2 0 277.368 2.557 20 5 CFBDRP CC[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000044515863 175190150 /nfs/dbraw/zinc/19/01/50/175190150.db2.gz XWIMRASRORWSSK-MRXNPFEDSA-N 2 0 291.395 2.977 20 5 CFBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)CCC2 ZINC000423247044 275038309 /nfs/dbraw/zinc/03/83/09/275038309.db2.gz KOBHCRZSKBWEPO-BLLLJJGKSA-N 2 0 289.379 2.561 20 5 CFBDRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000227495860 278255632 /nfs/dbraw/zinc/25/56/32/278255632.db2.gz QRFODMGDSJSEBF-ZDUSSCGKSA-N 2 0 291.395 2.977 20 5 CFBDRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc([N+](=O)[O-])cc1 ZINC000423549000 278343128 /nfs/dbraw/zinc/34/31/28/278343128.db2.gz HCYMTFHCUGMPJJ-GFCCVEGCSA-N 2 0 275.352 2.555 20 5 CFBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000423348124 279382137 /nfs/dbraw/zinc/38/21/37/279382137.db2.gz SQCKOKIKPICNOT-CJNGLKHVSA-N 2 0 291.395 2.505 20 5 CFBDRP C[C@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1ccc([N+](=O)[O-])cc1 ZINC000423260834 279471905 /nfs/dbraw/zinc/47/19/05/279471905.db2.gz QVZLNLXRCLBOGG-QWHCGFSZSA-N 2 0 277.368 2.635 20 5 CFBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@H]2C1 ZINC000252840207 290267653 /nfs/dbraw/zinc/26/76/53/290267653.db2.gz BMEZGTGZQZLEAC-DHMWGJHJSA-N 2 0 289.379 2.715 20 5 CFBDRP [NH3+][C@H]1CCC[C@@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000565783502 290325336 /nfs/dbraw/zinc/32/53/36/290325336.db2.gz BAJWKSDWANSDSN-LSDHHAIUSA-N 2 0 291.395 2.777 20 5 CFBDRP C[C@H](CC[NH3+])[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000414881189 533899615 /nfs/dbraw/zinc/89/96/15/533899615.db2.gz KSBAFDOLEBGERK-LLVKDONJSA-N 2 0 289.335 2.682 20 5 CFBDRP CC[C@@H]([NH2+]C1CCC([NH3+])CC1)c1cccc([N+](=O)[O-])c1 ZINC000051693017 618048363 /nfs/dbraw/zinc/04/83/63/618048363.db2.gz IXGDNFTXCKYAJY-SSDMNJCBSA-N 2 0 277.368 2.905 20 5 CFBDRP O=[N+]([O-])c1ccc(Cl)c(C[NH2+]CCC[C@H]2CCC[NH2+]2)c1 ZINC000841072079 620806112 /nfs/dbraw/zinc/80/61/12/620806112.db2.gz FTZCQLLMNJDDIK-LBPRGKRZSA-N 2 0 297.786 2.870 20 5 CFBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CC[C@H]([NH3+])C1 ZINC000925876443 619196747 /nfs/dbraw/zinc/19/67/47/619196747.db2.gz XZXBJRXKSYXLDD-GUTXKFCHSA-N 2 0 291.395 2.633 20 5 CFBDRP C[C@H](C[NH2+][C@H]1CCCC[C@H]1C[NH3+])c1ccccc1[N+](=O)[O-] ZINC000902432113 621077864 /nfs/dbraw/zinc/07/78/64/621077864.db2.gz VDSJXHZAXDSBOS-IPYPFGDCSA-N 2 0 291.395 2.805 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@@H](CC[NH3+])C1 ZINC000923480475 626475891 /nfs/dbraw/zinc/47/58/91/626475891.db2.gz HKDCPDWQEGZZGW-CHWSQXEVSA-N 2 0 277.368 2.635 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H](CC[NH3+])C1 ZINC000923480477 626476033 /nfs/dbraw/zinc/47/60/33/626476033.db2.gz HKDCPDWQEGZZGW-QWHCGFSZSA-N 2 0 277.368 2.635 20 5 CFBDRP CC(C)[C@H]([NH3+])CCNCc1cc(Cl)ccc1[N+](=O)[O-] ZINC000853247498 634950363 /nfs/dbraw/zinc/95/03/63/634950363.db2.gz RFMYBSIQNJPQIM-GFCCVEGCSA-N 2 0 285.775 2.711 20 5 CFBDRP CC1(C)C[C@@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)c2cc([N+](=O)[O-])ccc21 ZINC000873258630 642103461 /nfs/dbraw/zinc/10/34/61/642103461.db2.gz SXLBRDZQNJUHBJ-UEKVPHQBSA-N 2 0 289.379 2.644 20 5 CFBDRP C[C@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc([N+](=O)[O-])cc1 ZINC000873259145 642104527 /nfs/dbraw/zinc/10/45/27/642104527.db2.gz XXTZSYDVWPSYNT-VIRABCJISA-N 2 0 289.379 2.776 20 5 CFBDRP C[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])C12CCC2)c1ccc([N+](=O)[O-])cc1 ZINC000925675233 648275775 /nfs/dbraw/zinc/27/57/75/648275775.db2.gz MKNFFIOTRSWFKC-ZLKJLUDKSA-N 2 0 275.352 2.515 20 5 CFBDRP CC[C@@H]([NH2+]CC[C@@H]1C[NH2+]C[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000925797981 648326633 /nfs/dbraw/zinc/32/66/33/648326633.db2.gz JBVSWEHORQSQRS-XNRPHZJLSA-N 2 0 291.395 2.881 20 5 CFBDRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1OCC[N+](C)(C)C ZINC001224776498 775271791 /nfs/dbraw/zinc/27/17/91/775271791.db2.gz WKZJBSWJGAMICF-WMZOPIPTSA-N 2 0 291.459 2.620 20 5 CFBDRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000594508477 349434883 /nfs/dbraw/zinc/43/48/83/349434883.db2.gz CFDWKMSKXOXVOD-JMSVASOKSA-N 2 0 277.368 2.586 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)cc1[N+](=O)[O-] ZINC000594509021 349434905 /nfs/dbraw/zinc/43/49/05/349434905.db2.gz GSBFAOIRLLHNMU-NFAWXSAZSA-N 2 0 291.395 2.894 20 5 CFBDRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000596111678 349797454 /nfs/dbraw/zinc/79/74/54/349797454.db2.gz ZZQOFZGYLYCYGH-DZGCQCFKSA-N 2 0 293.411 2.879 20 5 CFBDRP C[C@@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000037775679 346333598 /nfs/dbraw/zinc/33/35/98/346333598.db2.gz KIBUPWYWLHLJPI-QWHCGFSZSA-N 2 0 291.395 2.976 20 5 CFBDRP Cc1ccc(CNC[C@H]2CC[N@@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000040623006 346346553 /nfs/dbraw/zinc/34/65/53/346346553.db2.gz QPNVPCVLIIJGLY-OAHLLOKOSA-N 2 0 291.395 2.723 20 5 CFBDRP C[NH+](C)C1CCC([NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000586790004 348753235 /nfs/dbraw/zinc/75/32/35/348753235.db2.gz YVJYADQCFQHPQR-UHFFFAOYSA-N 2 0 291.395 2.600 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](C)[C@@H]1CC[NH3+] ZINC000593316199 349246464 /nfs/dbraw/zinc/24/64/64/349246464.db2.gz NAZWLHFJPQLPKE-WBMJQRKESA-N 2 0 291.395 2.853 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000414794473 233353638 /nfs/dbraw/zinc/35/36/38/233353638.db2.gz FRZQUANUPMYPGE-SWLSCSKDSA-N 2 0 277.368 2.510 20 5 CFBDRP O=[N+]([O-])c1ccccc1/C=C\C[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000414849359 233377449 /nfs/dbraw/zinc/37/74/49/233377449.db2.gz LSMPJBRAWFTOPK-HJHHMULASA-N 2 0 289.379 2.587 20 5 CFBDRP C[C@@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1ccc([N+](=O)[O-])cc1 ZINC000602020574 350834180 /nfs/dbraw/zinc/83/41/80/350834180.db2.gz MQPSGVBQXHJGMB-YRGRVCCFSA-N 2 0 277.368 2.763 20 5 CFBDRP C[NH+]1CCC2(CC[N@H+](Cc3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000602875938 351054735 /nfs/dbraw/zinc/05/47/35/351054735.db2.gz BVYLXHHRRYBIKN-UHFFFAOYSA-N 2 0 289.379 2.513 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+][C@H](C)CCC[NH3+])cc1[N+](=O)[O-] ZINC000422917968 237343782 /nfs/dbraw/zinc/34/37/82/237343782.db2.gz GKUUFAWZGNGQEL-VXGBXAGGSA-N 2 0 265.357 2.681 20 5 CFBDRP C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000431039829 239841283 /nfs/dbraw/zinc/84/12/83/239841283.db2.gz YLVVFLHHLFPHFB-CYBMUJFWSA-N 2 0 289.379 2.731 20 5 CFBDRP C[C@H]([NH2+][C@H]1CCCC[C@H]1C[NH3+])c1ccc([N+](=O)[O-])cc1 ZINC000423278260 299417919 /nfs/dbraw/zinc/41/79/19/299417919.db2.gz QLMXTPVBZKMMTA-WHOFXGATSA-N 2 0 277.368 2.763 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000459729067 245287480 /nfs/dbraw/zinc/28/74/80/245287480.db2.gz DFYQDORMSYZQNV-AWEZNQCLSA-N 2 0 291.395 2.725 20 5 CFBDRP Cc1ccc(C[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000459732827 245291187 /nfs/dbraw/zinc/29/11/87/245291187.db2.gz NBUTZTPCSPBULY-AWEZNQCLSA-N 2 0 291.395 2.725 20 5 CFBDRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000037648973 372684625 /nfs/dbraw/zinc/68/46/25/372684625.db2.gz WGFMZHYTQZWONB-STQMWFEESA-N 2 0 289.379 2.730 20 5 CFBDRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000037649073 372685452 /nfs/dbraw/zinc/68/54/52/372685452.db2.gz RLMAZQJYXUPRKH-STQMWFEESA-N 2 0 289.379 2.730 20 5 CFBDRP CC[C@@H]([NH2+]CCCC[NH+](C)C)c1cccc([N+](=O)[O-])c1 ZINC000045663636 373026142 /nfs/dbraw/zinc/02/61/42/373026142.db2.gz XXFQRPFKCGTEBY-OAHLLOKOSA-N 2 0 279.384 2.977 20 5 CFBDRP Cc1ccc([C@@H](C)[NH2+]C2CCC([NH3+])CC2)cc1[N+](=O)[O-] ZINC000051693112 373406268 /nfs/dbraw/zinc/40/62/68/373406268.db2.gz LCVCELKRIYOSPT-LMWSTFAQSA-N 2 0 277.368 2.824 20 5 CFBDRP CC1(C)C[NH2+]CC[C@@H]1[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000414968425 381665566 /nfs/dbraw/zinc/66/55/66/381665566.db2.gz IBBKUWWFAACTIC-ZKKXHLJNSA-N 2 0 289.379 2.586 20 5 CFBDRP CC1(C)C[NH2+]CC[C@H]1[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000414968427 381665857 /nfs/dbraw/zinc/66/58/57/381665857.db2.gz IBBKUWWFAACTIC-ZQMJAJRESA-N 2 0 289.379 2.586 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)CCCC[NH3+] ZINC000415021356 381715426 /nfs/dbraw/zinc/71/54/26/381715426.db2.gz YJCILKCWXYDLGE-GFCCVEGCSA-N 2 0 265.357 2.510 20 5 CFBDRP O=[N+]([O-])c1ccc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)c(Cl)c1 ZINC000414980038 381675626 /nfs/dbraw/zinc/67/56/26/381675626.db2.gz WEIOZKTVBPVMCW-GFCCVEGCSA-N 2 0 297.786 2.870 20 5 CFBDRP Cc1ccc(C[NH2+]C[C@H]2CCC[C@H]([NH3+])C2)cc1[N+](=O)[O-] ZINC000414984863 381679643 /nfs/dbraw/zinc/67/96/43/381679643.db2.gz ATAIERZETNWZJQ-JSGCOSHPSA-N 2 0 277.368 2.510 20 5 CFBDRP Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@@H]1CCC[C@H]([NH3+])C1 ZINC000415006153 381698350 /nfs/dbraw/zinc/69/83/50/381698350.db2.gz PWKXOTWUYJMERH-OCCSQVGLSA-N 2 0 277.368 2.510 20 5 CFBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCC[NH2+]C1 ZINC000415069136 381754867 /nfs/dbraw/zinc/75/48/67/381754867.db2.gz GDHHYVQTWFGPJL-DZGCQCFKSA-N 2 0 291.395 2.648 20 5 CFBDRP O=[N+]([O-])c1cccc(C[NH2+]CCCCC[NH+]2CCCC2)c1 ZINC000292896762 381892139 /nfs/dbraw/zinc/89/21/39/381892139.db2.gz DHPSLXQWZQCPDF-UHFFFAOYSA-N 2 0 291.395 2.951 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](C)C[NH+](C)C ZINC000293815274 382289712 /nfs/dbraw/zinc/28/97/12/382289712.db2.gz VUAMZTCDTAWENB-UONOGXRCSA-N 2 0 293.411 2.703 20 5 CFBDRP CC[C@H]([NH2+][C@H]1CC[NH2+]C[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000423383799 383075885 /nfs/dbraw/zinc/07/58/85/383075885.db2.gz FGXPXNWZWQEKJR-CQDKDKBSSA-N 2 0 277.368 2.634 20 5 CFBDRP Cc1c([C@H](C)[NH2+][C@@H]2CC[NH2+]C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000423398898 383081990 /nfs/dbraw/zinc/08/19/90/383081990.db2.gz PEAJBEYLERJWTR-VHRBIJSZSA-N 2 0 277.368 2.552 20 5 CFBDRP C[C@H](CCC[NH3+])[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000423464957 383106085 /nfs/dbraw/zinc/10/60/85/383106085.db2.gz WCMZBFNDHPMWFG-DOMZBBRYSA-N 2 0 291.395 2.633 20 5 CFBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC(C)(C)C[NH+](C)C ZINC000449064903 383157591 /nfs/dbraw/zinc/15/75/91/383157591.db2.gz WWOBZLJMBDSIDR-CYBMUJFWSA-N 2 0 293.411 2.703 20 5 CFBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](C)C[NH+](C)C ZINC000491558901 533408750 /nfs/dbraw/zinc/40/87/50/533408750.db2.gz HSBBDGKYMSNCCO-MAUPQMMJSA-N 2 0 291.395 2.785 20 5 CFBDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000249382675 131121489 /nfs/dbraw/zinc/12/14/89/131121489.db2.gz UAIZWNOYVZCUQP-OLZOCXBDSA-N 2 0 277.368 2.587 20 5 CFBDRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccc([N+](=O)[O-])cc1 ZINC000423538392 394293775 /nfs/dbraw/zinc/29/37/75/394293775.db2.gz GEAJOEAMRAVNIE-SPWCGHHHSA-N 2 0 289.379 2.634 20 5 CFBDRP CC[C@@H]([NH2+]CC[C@H]1CCC[NH2+]1)c1cccc([N+](=O)[O-])c1 ZINC000423369104 286909062 /nfs/dbraw/zinc/90/90/62/286909062.db2.gz SIZZCHLKOCXBFM-UKRRQHHQSA-N 2 0 277.368 2.778 20 5 CFBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCC[NH+](C)C ZINC000344860660 162136078 /nfs/dbraw/zinc/13/60/78/162136078.db2.gz PPIDPSWAPPHINU-RAXLEYEMSA-N 2 0 277.368 2.539 20 5 CFBDRP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000044534131 175197151 /nfs/dbraw/zinc/19/71/51/175197151.db2.gz YQKQOUWAJLXWJN-CZUORRHYSA-N 2 0 291.395 2.977 20 5 CFBDRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000227495852 278339799 /nfs/dbraw/zinc/33/97/99/278339799.db2.gz QRFODMGDSJSEBF-CYBMUJFWSA-N 2 0 291.395 2.977 20 5 CFBDRP C[C@@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000414181081 278348020 /nfs/dbraw/zinc/34/80/20/278348020.db2.gz MMLJJJYWOUBHIY-KGLIPLIRSA-N 2 0 291.395 2.977 20 5 CFBDRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000423383801 288070337 /nfs/dbraw/zinc/07/03/37/288070337.db2.gz FGXPXNWZWQEKJR-TUKIKUTGSA-N 2 0 277.368 2.634 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H](C)[C@H](C[NH3+])C1 ZINC000420406846 281021099 /nfs/dbraw/zinc/02/10/99/281021099.db2.gz OCHNFXOINFPZES-KWCYVHTRSA-N 2 0 291.395 2.881 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCC[NH+](C)C ZINC000532218620 281445770 /nfs/dbraw/zinc/44/57/70/281445770.db2.gz BSGKOWMEWPTYAM-CYBMUJFWSA-N 2 0 279.384 2.896 20 5 CFBDRP C[C@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[NH2+]1 ZINC000422920624 533844452 /nfs/dbraw/zinc/84/44/52/533844452.db2.gz MJEOXGKTCVNMEE-BBRMVZONSA-N 2 0 291.395 2.648 20 5 CFBDRP CCC[C@H]([NH2+]C[C@H](C)C[NH2+]C)c1cccc([N+](=O)[O-])c1 ZINC000423255484 528223754 /nfs/dbraw/zinc/22/37/54/528223754.db2.gz AFUBCZGRNWKQKR-DOMZBBRYSA-N 2 0 279.384 2.881 20 5 CFBDRP CC1(C)C[NH2+]CC[C@@H]([NH2+]CCc2ccccc2[N+](=O)[O-])C1 ZINC000902332161 621038994 /nfs/dbraw/zinc/03/89/94/621038994.db2.gz CUADVMHZMBIASI-CQSZACIVSA-N 2 0 291.395 2.505 20 5 CFBDRP CC1(C)C[NH2+]CC[C@@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C1 ZINC000902366996 621043025 /nfs/dbraw/zinc/04/30/25/621043025.db2.gz BYYZYHLHFGSTMZ-CQSZACIVSA-N 2 0 291.395 2.505 20 5 CFBDRP CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1C[NH2+]C[C@H]1C ZINC000903432599 621373067 /nfs/dbraw/zinc/37/30/67/621373067.db2.gz GBEPJKGACIESFI-HIFRSBDPSA-N 2 0 291.395 2.661 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1C[C@@H](C)[C@H](CC[NH3+])C1 ZINC000903498283 621394233 /nfs/dbraw/zinc/39/42/33/621394233.db2.gz BUTXPTPIQWAWPR-MGPQQGTHSA-N 2 0 291.395 2.881 20 5 CFBDRP C[C@H]1C[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC[C@@H]1C[NH3+] ZINC000923496426 626476597 /nfs/dbraw/zinc/47/65/97/626476597.db2.gz IDZHDERHMCPFTB-WDEREUQCSA-N 2 0 297.786 2.665 20 5 CFBDRP C[N@@H+](Cc1c2ccccc2cc2ccccc21)C[C@@H](O)C[NH3+] ZINC000841093935 631338669 /nfs/dbraw/zinc/33/86/69/631338669.db2.gz VUPHOCYXBIAZPE-INIZCTEOSA-N 2 0 294.398 2.744 20 5 CFBDRP C[C@@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])C1CC[NH2+]CC1 ZINC000873221798 642075443 /nfs/dbraw/zinc/07/54/43/642075443.db2.gz QKOQOXFUTUTHBX-DIECRNLCSA-N 2 0 289.379 2.586 20 5 CFBDRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000877073214 643135446 /nfs/dbraw/zinc/13/54/46/643135446.db2.gz FNXCLVYHILKGAC-GOEBONIOSA-N 2 0 291.395 2.600 20 5 CFBDRP Cc1ccc(C[NH2+][C@H]2C[C@@H]([NH3+])CC(C)(C)C2)cc1[N+](=O)[O-] ZINC000925735821 648303407 /nfs/dbraw/zinc/30/34/07/648303407.db2.gz YBZYBLYUDCUIHJ-KGLIPLIRSA-N 2 0 291.395 2.899 20 5 CFBDRP CC[C@H]([NH2+]CCC(C)(C)[NH3+])c1cccc([N+](=O)[O-])c1 ZINC000925740253 648305617 /nfs/dbraw/zinc/30/56/17/648305617.db2.gz GUMRMOOPFBQZIZ-ZDUSSCGKSA-N 2 0 265.357 2.763 20 5 CFBDRP C[C@H](c1ccccc1[N+](=O)[O-])N1C[C@@H]2C[N@H+](C)C[C@]2(C)C1 ZINC000933739962 649718357 /nfs/dbraw/zinc/71/83/57/649718357.db2.gz DUQGEDPZHDRBTQ-DVOMOZLQSA-N 2 0 289.379 2.539 20 5 CFBDRP C[NH+](C)CC[C@H](OCCC[N+](C)(C)C)c1cccs1 ZINC001224618068 775228335 /nfs/dbraw/zinc/22/83/35/775228335.db2.gz CBRLTNQTSJYBKE-AWEZNQCLSA-N 2 0 285.477 2.854 20 5 CFBDRP Cc1c(C[N@H+]2CCC[C@H](C)[C@@H]2CC[NH3+])cccc1[N+](=O)[O-] ZINC000404382714 348591089 /nfs/dbraw/zinc/59/10/89/348591089.db2.gz NCMZXYMDCYCQBX-WFASDCNBSA-N 2 0 291.395 2.853 20 5 CFBDRP C[C@@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H]1CC[NH3+] ZINC000404411541 348591317 /nfs/dbraw/zinc/59/13/17/348591317.db2.gz XWRFMUQMCUNIAL-CJNGLKHVSA-N 2 0 291.395 2.587 20 5 CFBDRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000414826174 233367678 /nfs/dbraw/zinc/36/76/78/233367678.db2.gz VCFMZTKNRVGAJP-GZBFAFLISA-N 2 0 291.395 2.633 20 5 CFBDRP O=[N+]([O-])c1ccc(C[NH2+]CC[C@H]2CCC[NH2+]C2)c(Cl)c1 ZINC000414837023 233372628 /nfs/dbraw/zinc/37/26/28/233372628.db2.gz JYTKXURDHHHOFU-LLVKDONJSA-N 2 0 297.786 2.728 20 5 CFBDRP C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)CC1CC[NH2+]CC1 ZINC000178956523 189157462 /nfs/dbraw/zinc/15/74/62/189157462.db2.gz LJUNPTPFUYMSIE-UHFFFAOYSA-N 2 0 297.786 2.680 20 5 CFBDRP Cc1c([C@@H](C)N[C@H](C[NH3+])CC(C)C)cccc1[N+](=O)[O-] ZINC000423259001 238313739 /nfs/dbraw/zinc/31/37/39/238313739.db2.gz CVVVRWARNFLJRY-OLZOCXBDSA-N 2 0 279.384 2.927 20 5 CFBDRP CC[C@H]([NH2+]CCCC[NH+](C)C)c1cccc([N+](=O)[O-])c1 ZINC000045663635 373027031 /nfs/dbraw/zinc/02/70/31/373027031.db2.gz XXFQRPFKCGTEBY-HNNXBMFYSA-N 2 0 279.384 2.977 20 5 CFBDRP C[NH2+]CC1CC[NH+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000063159072 373789158 /nfs/dbraw/zinc/78/91/58/373789158.db2.gz KJMRPRHDGUNUIC-LBPRGKRZSA-N 2 0 277.368 2.587 20 5 CFBDRP C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[C@@H](C)[C@@H](C[NH3+])C1 ZINC000163408411 378969877 /nfs/dbraw/zinc/96/98/77/378969877.db2.gz KCKPRPLUDBIBDB-DYEKYZERSA-N 2 0 277.368 2.573 20 5 CFBDRP CC1(C)C[NH2+]CC[C@H]1[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000414968421 381666280 /nfs/dbraw/zinc/66/62/80/381666280.db2.gz IBBKUWWFAACTIC-KEDPEKRHSA-N 2 0 289.379 2.586 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H]([C@H](C)[NH3+])C1 ZINC000420300906 382352289 /nfs/dbraw/zinc/35/22/89/382352289.db2.gz DHXDICPFPQJHDQ-AVGNSLFASA-N 2 0 277.368 2.633 20 5 CFBDRP [NH3+]CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)CC1CCCC1 ZINC000352509845 382375525 /nfs/dbraw/zinc/37/55/25/382375525.db2.gz LNJRVHKZTOHQJQ-UHFFFAOYSA-N 2 0 291.395 2.936 20 5 CFBDRP O=[N+]([O-])c1cccc(C[N@H+](CC[C@@H]2CC[NH2+]C2)C2CC2)c1 ZINC000420369606 382391066 /nfs/dbraw/zinc/39/10/66/382391066.db2.gz XUSOCEDMDDGRLX-ZDUSSCGKSA-N 2 0 289.379 2.559 20 5 CFBDRP CC[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1 ZINC000420415765 382402868 /nfs/dbraw/zinc/40/28/68/382402868.db2.gz VFRKJXDBEFWNDS-DOMZBBRYSA-N 2 0 277.368 2.635 20 5 CFBDRP CC(C)[C@H]([NH3+])CC[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000346693377 382477881 /nfs/dbraw/zinc/47/78/81/382477881.db2.gz MRZAASLRAXXNNB-DDJMYBDESA-N 2 0 291.395 2.913 20 5 CFBDRP C[C@@H](c1ccccc1[N+](=O)[O-])N1[C@@H]2CC[C@H]1CC[N@@H+](C)C2 ZINC000577579439 382863687 /nfs/dbraw/zinc/86/36/87/382863687.db2.gz MTIQTQWPOUCPFH-MELADBBJSA-N 2 0 289.379 2.824 20 5 CFBDRP C[NH2+]C[C@H](C)C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000423275179 383055207 /nfs/dbraw/zinc/05/52/07/383055207.db2.gz MTRXLBSXCMWVIR-NHYWBVRUSA-N 2 0 291.395 2.762 20 5 CFBDRP [NH3+]C[C@H]1CCC[C@@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000423037374 383023468 /nfs/dbraw/zinc/02/34/68/383023468.db2.gz BHDDTCKLOMAJKR-YPMHNXCESA-N 2 0 297.786 2.508 20 5 CFBDRP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc([N+](=O)[O-])cc1 ZINC000423480985 383114134 /nfs/dbraw/zinc/11/41/34/383114134.db2.gz NWPRENDJPIUFJO-GXTWGEPZSA-N 2 0 277.368 2.778 20 5 CFBDRP CC[C@H]([NH3+])C[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000414994740 393809352 /nfs/dbraw/zinc/80/93/52/393809352.db2.gz VESOBVAONWEIOB-SNPRPXQTSA-N 2 0 291.395 2.633 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC(C[NH3+])CC1 ZINC000420281253 394114727 /nfs/dbraw/zinc/11/47/27/394114727.db2.gz ZZQDSQOMKHBDAS-LBPRGKRZSA-N 2 0 277.368 2.635 20 5 CFBDRP Cc1c(C[NH2+]C2CCC(C[NH3+])CC2)cccc1[N+](=O)[O-] ZINC000423078721 394265226 /nfs/dbraw/zinc/26/52/26/394265226.db2.gz PAHSGZJTXVPFAH-UHFFFAOYSA-N 2 0 277.368 2.510 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@@H](C[NH3+])C[C@H]1C ZINC000420319806 292296645 /nfs/dbraw/zinc/29/66/45/292296645.db2.gz POASBYLIXRTGCZ-FRRDWIJNSA-N 2 0 277.368 2.633 20 5 CFBDRP Cc1ccc(C[NH+]2CCC(C[NH+](C)C)CC2)cc1[N+](=O)[O-] ZINC000350175758 163065978 /nfs/dbraw/zinc/06/59/78/163065978.db2.gz JAVDDTDKPSSOTG-UHFFFAOYSA-N 2 0 291.395 2.677 20 5 CFBDRP CC[NH+]1CCC(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000044517670 175190556 /nfs/dbraw/zinc/19/05/56/175190556.db2.gz ACWWRJIXUSRKIH-CYBMUJFWSA-N 2 0 291.395 2.977 20 5 CFBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1CC[NH2+]CC1 ZINC000517024066 270395900 /nfs/dbraw/zinc/39/59/00/270395900.db2.gz XXCAFWFONQEOLW-ZDUSSCGKSA-N 2 0 291.395 2.505 20 5 CFBDRP C[C@@H](CCC[NH3+])[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000423471704 274208587 /nfs/dbraw/zinc/20/85/87/274208587.db2.gz ZRFDWXNZFQTPIV-NHYWBVRUSA-N 2 0 277.368 2.689 20 5 CFBDRP C[C@@H](C[NH3+])C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000423308907 278245676 /nfs/dbraw/zinc/24/56/76/278245676.db2.gz PFIMICFQZWZIFM-IINYFYTJSA-N 2 0 277.368 2.502 20 5 CFBDRP C[C@H]([NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1)c1ccc([N+](=O)[O-])cc1 ZINC000423458398 278261866 /nfs/dbraw/zinc/26/18/66/278261866.db2.gz JTCDZATWRODERH-OUCADQQQSA-N 2 0 277.368 2.763 20 5 CFBDRP CC[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000422842959 288067571 /nfs/dbraw/zinc/06/75/71/288067571.db2.gz ZWOZNQVDXAQHNC-HIFRSBDPSA-N 2 0 277.368 2.778 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H]([C@H](C)[NH3+])C1 ZINC000420300908 281022006 /nfs/dbraw/zinc/02/20/06/281022006.db2.gz DHXDICPFPQJHDQ-RWMBFGLXSA-N 2 0 277.368 2.633 20 5 CFBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H]2CCC[C@H]([NH3+])[C@H]2C1 ZINC000252867195 290251593 /nfs/dbraw/zinc/25/15/93/290251593.db2.gz QTZLMXSNAADVME-XTBFLFJDSA-N 2 0 289.379 2.715 20 5 CFBDRP [NH3+][C@H]1CCC[C@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000565783500 290325413 /nfs/dbraw/zinc/32/54/13/290325413.db2.gz BAJWKSDWANSDSN-GJZGRUSLSA-N 2 0 291.395 2.777 20 5 CFBDRP C[C@@H](C[NH3+])C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000414876998 533772132 /nfs/dbraw/zinc/77/21/32/533772132.db2.gz MGBJVNLLRRVIHO-NSHDSACASA-N 2 0 289.335 2.539 20 5 CFBDRP Cc1c([C@H](C)[NH2+][C@H](C)[C@H]2CCC[NH2+]C2)cccc1[N+](=O)[O-] ZINC000423221841 533955348 /nfs/dbraw/zinc/95/53/48/533955348.db2.gz YJRCWXQZIJTSAT-RDBSUJKOSA-N 2 0 291.395 2.942 20 5 CFBDRP CC1(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CC[NH2+]CC1 ZINC000414897083 527980848 /nfs/dbraw/zinc/98/08/48/527980848.db2.gz DGFZZBILXMNQEW-UHFFFAOYSA-N 2 0 297.786 2.728 20 5 CFBDRP CC(C)c1ccc(C[NH2+][C@H](C)CCC[NH3+])cc1[N+](=O)[O-] ZINC000415028302 528099806 /nfs/dbraw/zinc/09/98/06/528099806.db2.gz YMMIZNJDVODNEV-GFCCVEGCSA-N 2 0 279.384 2.935 20 5 CFBDRP CCC[C@@H]([NH2+]C[C@H](C)C[NH2+]C)c1cccc([N+](=O)[O-])c1 ZINC000423255485 529011014 /nfs/dbraw/zinc/01/10/14/529011014.db2.gz AFUBCZGRNWKQKR-IUODEOHRSA-N 2 0 279.384 2.881 20 5 CFBDRP O=[N+]([O-])c1ccc(Cl)c(C[NH2+]CCC[C@@H]2CCC[NH2+]2)c1 ZINC000841072077 620796425 /nfs/dbraw/zinc/79/64/25/620796425.db2.gz FTZCQLLMNJDDIK-GFCCVEGCSA-N 2 0 297.786 2.870 20 5 CFBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC[C@@H](C)[NH+](C)C ZINC000895292256 618514959 /nfs/dbraw/zinc/51/49/59/618514959.db2.gz ALKHFBLGOQAYAZ-ZIAGYGMSSA-N 2 0 293.411 2.846 20 5 CFBDRP C[C@@H]([NH2+][C@H]1C[C@H]([NH3+])C12CCC2)c1ccc([N+](=O)[O-])cc1 ZINC000925826417 619153683 /nfs/dbraw/zinc/15/36/83/619153683.db2.gz MKNFFIOTRSWFKC-SWHYSGLUSA-N 2 0 275.352 2.515 20 5 CFBDRP C[C@@H](C[NH2+][C@@H](C)CCCC[NH3+])c1ccccc1[N+](=O)[O-] ZINC000902429412 621076606 /nfs/dbraw/zinc/07/66/06/621076606.db2.gz KZZRHJRJOYFUNQ-STQMWFEESA-N 2 0 279.384 2.805 20 5 CFBDRP C[C@@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1[N+](=O)[O-] ZINC000902432695 621078096 /nfs/dbraw/zinc/07/80/96/621078096.db2.gz WIZHLCCPLRIEPC-ICIURTGMSA-N 2 0 289.379 2.571 20 5 CFBDRP C[C@@H]1C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])CC[C@@H]1C[NH3+] ZINC000904410706 621591951 /nfs/dbraw/zinc/59/19/51/621591951.db2.gz FTONZDSFZHNKIM-AVXNYWLKSA-N 2 0 289.379 2.525 20 5 CFBDRP C[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC[C@H]1C[NH3+] ZINC000904411586 621592682 /nfs/dbraw/zinc/59/26/82/621592682.db2.gz NTKRBWHJMUWSJR-QWRGUYRKSA-N 2 0 297.786 2.665 20 5 CFBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](C[NH3+])[C@H](C)C1 ZINC000923497915 626477238 /nfs/dbraw/zinc/47/72/38/626477238.db2.gz NEURJZRHJWDHIF-JHJVBQTASA-N 2 0 277.368 2.573 20 5 CFBDRP [NH3+]CCCCCC[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000843129696 631849265 /nfs/dbraw/zinc/84/92/65/631849265.db2.gz XSHYMWVHYIFOJF-CLFYSBASSA-N 2 0 277.368 2.717 20 5 CFBDRP C[NH+](C)C1(C)CCC([NH2+]Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000865765835 638562166 /nfs/dbraw/zinc/56/21/66/638562166.db2.gz OCAYZNHPZCSMGW-UHFFFAOYSA-N 2 0 291.395 2.947 20 5 CFBDRP C[NH+](C)C1(C)CCC([NH2+]Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000865765747 638562254 /nfs/dbraw/zinc/56/22/54/638562254.db2.gz KOZWEMXEYYWXEM-UHFFFAOYSA-N 2 0 291.395 2.947 20 5 CFBDRP CC[C@@H]([NH2+]CCC(C)(C)[NH3+])c1cccc([N+](=O)[O-])c1 ZINC000925740251 648305385 /nfs/dbraw/zinc/30/53/85/648305385.db2.gz GUMRMOOPFBQZIZ-CYBMUJFWSA-N 2 0 265.357 2.763 20 5 CFBDRP CCOc1ccc([C@@H](C)[NH2+]CCC(C)(C)[NH3+])cc1[N+](=O)[O-] ZINC000925739632 648305446 /nfs/dbraw/zinc/30/54/46/648305446.db2.gz BIWSNRVWNUQXHL-LLVKDONJSA-N 2 0 295.383 2.772 20 5 CFBDRP C[N+](C)(C)CCCO[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001224619141 775228202 /nfs/dbraw/zinc/22/82/02/775228202.db2.gz MDPHOWTUIMNLQB-GOSISDBHSA-N 2 0 291.459 2.764 20 5 CFBDRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1OCC[N+](C)(C)C ZINC001224776496 775271368 /nfs/dbraw/zinc/27/13/68/775271368.db2.gz WKZJBSWJGAMICF-FUHWJXTLSA-N 2 0 291.459 2.620 20 5 CFBDRP CC[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000594510874 349435485 /nfs/dbraw/zinc/43/54/85/349435485.db2.gz PFTRAUUCRXZRAS-UHOFOFEASA-N 2 0 291.395 2.976 20 5 CFBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCCC[NH3+] ZINC000423318871 529534345 /nfs/dbraw/zinc/53/43/45/529534345.db2.gz DWXNDWAUBGOVSZ-LBPRGKRZSA-N 2 0 297.424 2.794 20 5 CFBDRP C[NH2+]C[C@H](C)[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000596105317 349795380 /nfs/dbraw/zinc/79/53/80/349795380.db2.gz KCDCBAGIJPPXPH-YDHLFZDLSA-N 2 0 291.395 2.504 20 5 CFBDRP Cc1c([C@H](C)[NH2+]CCC2(C[NH3+])CC2)cccc1[N+](=O)[O-] ZINC000593319839 349246541 /nfs/dbraw/zinc/24/65/41/349246541.db2.gz PRVFELMVETXKFQ-LBPRGKRZSA-N 2 0 277.368 2.683 20 5 CFBDRP Cc1ccc(C[N@H+]2CCC[C@@H](C)[C@@H]2CC[NH3+])cc1[N+](=O)[O-] ZINC000593317797 349246674 /nfs/dbraw/zinc/24/66/74/349246674.db2.gz YOYINBVHOVRYFV-DOMZBBRYSA-N 2 0 291.395 2.853 20 5 CFBDRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])cc1 ZINC000414809358 233360727 /nfs/dbraw/zinc/36/07/27/233360727.db2.gz MHUZFFSPYYVLTH-GFCCVEGCSA-N 2 0 285.347 2.904 20 5 CFBDRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1ccc([N+](=O)[O-])cc1 ZINC000602020573 350834144 /nfs/dbraw/zinc/83/41/44/350834144.db2.gz MQPSGVBQXHJGMB-OBJOEFQTSA-N 2 0 277.368 2.763 20 5 CFBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1C[C@H]([NH3+])C1(C)C ZINC000603431706 351163239 /nfs/dbraw/zinc/16/32/39/351163239.db2.gz GJNPGBZDGTWTRA-BPNCWPANSA-N 2 0 277.368 2.680 20 5 CFBDRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000222967251 540151993 /nfs/dbraw/zinc/15/19/93/540151993.db2.gz HWODEEVOLQUFFW-UHTWSYAYSA-N 2 0 263.341 2.515 20 5 CFBDRP C[C@H]([NH2+]C1CCC([NH3+])CC1)c1cccc([N+](=O)[O-])c1 ZINC000051693094 373405313 /nfs/dbraw/zinc/40/53/13/373405313.db2.gz CALMWESRHMPQGF-PKSQDBQZSA-N 2 0 263.341 2.515 20 5 CFBDRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000332298313 378744289 /nfs/dbraw/zinc/74/42/89/378744289.db2.gz MRCZVQULAYPHIM-IOASZLSFSA-N 2 0 289.379 2.832 20 5 CFBDRP O=[N+]([O-])c1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000278553228 194039561 /nfs/dbraw/zinc/03/95/61/194039561.db2.gz ZNHBOOXIDXDVPV-UHFFFAOYSA-N 2 0 289.379 2.559 20 5 CFBDRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000400997266 380867243 /nfs/dbraw/zinc/86/72/43/380867243.db2.gz JIPZGDSXZNGQNL-ZGKBOVNRSA-N 2 0 289.379 2.634 20 5 CFBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCC[NH2+]C1 ZINC000415069411 381753165 /nfs/dbraw/zinc/75/31/65/381753165.db2.gz GDHHYVQTWFGPJL-ZFWWWQNUSA-N 2 0 291.395 2.648 20 5 CFBDRP Cc1c(C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])cccc1[N+](=O)[O-] ZINC000231883871 382867612 /nfs/dbraw/zinc/86/76/12/382867612.db2.gz JDMYSPCJPWCFGL-TZMCWYRMSA-N 2 0 277.368 2.510 20 5 CFBDRP Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)cc1[N+](=O)[O-] ZINC000423393629 383079853 /nfs/dbraw/zinc/07/98/53/383079853.db2.gz QSZOVAOVPZXWLA-IACUBPJLSA-N 2 0 277.368 2.824 20 5 CFBDRP C[C@H]([NH3+])[C@H](C)[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000423433434 383095326 /nfs/dbraw/zinc/09/53/26/383095326.db2.gz CJIATJDVNQFWAC-XPCVCDNBSA-N 2 0 291.395 2.631 20 5 CFBDRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1 ZINC000423546507 394295800 /nfs/dbraw/zinc/29/58/00/394295800.db2.gz FJTZGZXUZVBVOB-LBPRGKRZSA-N 2 0 275.352 2.555 20 5 CFBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000414827327 533681404 /nfs/dbraw/zinc/68/14/04/533681404.db2.gz KJFPKPAAMDNOEN-KBPBESRZSA-N 2 0 291.395 2.505 20 5 CFBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)CCC2 ZINC000423216085 275038295 /nfs/dbraw/zinc/03/82/95/275038295.db2.gz RKMLPDPEDSTABE-MLGOLLRUSA-N 2 0 289.379 2.561 20 5 CFBDRP